4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine

C47H71N7 — CID 161392190

IUPAC4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine
SMILESCC(C)c1ccncc1.CN(C)c1cc(C(C)(C)C)ccn1.Cc1cc(C(C)C)cc(C)n1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)nc(C)n1
InChIInChI=1S/C11H18N2.C10H15N.C9H14N2.C9H13N.C8H11N/c1-11(2,3)9-6-7-12-10(8-9)13(4)5;1-7(2)10-5-8(3)11-9(4)6-10;1-6(2)9-5-7(3)10-8(4)11-9;1-7(2)9-4-5-10-8(3)6-9;1-7(2)8-3-5-9-6-4-8/h6-8H,1-5H3;5-7H,1-4H3;5-6H,1-4H3;4-7H,1-3H3;3-7H,1-2H3
InChIKeyVTDBJSSEAKTYJK-UHFFFAOYSA-N
MW734.13 g/mol
LogP12.20
Rot. Bonds5

About 4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine

4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine (PubChem CID 161392190) has the molecular formula C47H71N7 and a molecular weight of 734.13 g/mol. Its IUPAC name is 4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine.

Molecular Properties

Compound Name4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine
PubChem CID161392190
Molecular FormulaC47H71N7
Molecular Weight734.13 g/mol
Exact Mass733.58
IUPAC Name4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine
SMILESCC(C)c1ccncc1.CN(C)c1cc(C(C)(C)C)ccn1.Cc1cc(C(C)C)cc(C)n1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)nc(C)n1
InChIInChI=1S/C11H18N2.C10H15N.C9H14N2.C9H13N.C8H11N/c1-11(2,3)9-6-7-12-10(8-9)13(4)5;1-7(2)10-5-8(3)11-9(4)6-10;1-6(2)9-5-7(3)10-8(4)11-9;1-7(2)9-4-5-10-8(3)6-9;1-7(2)8-3-5-9-6-4-8/h6-8H,1-5H3;5-7H,1-4H3;5-6H,1-4H3;4-7H,1-3H3;3-7H,1-2H3
InChIKeyVTDBJSSEAKTYJK-UHFFFAOYSA-N
XLogP12.20
TPSA80.58 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500734.13
LogP ≤ 512.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine
CID 176692961
hexakis(carbon dioxide);bis(2-methyl-4-propan-2-ylpyridine);2-propan-2-ylpyridine;bis(3-propan-2-ylpyridine);4-propan-2-ylpyridine
CID 158081858
4-tert-butyl-2-(4-propan-2-ylphenyl)pyridine
CID 178179780
2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine
CID 176699723
bis(2-methyl-4-propan-2-ylpyridine);2-propan-2-ylphenol
CID 161345551
1-(2-methyl-4-pyridinyl)ethanol
CID 106756390
4-propan-2-yl-N-pyridin-2-yl-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 173090911
N,N,4-trimethylpyridin-2-amine
CID 18797061
ethane;2-propan-2-ylpyridine;4-propan-2-ylpyridine
CID 159031608
2-chloro-6-methyl-4-propan-2-ylpyridine
CID 19867375
4-methyl-N-[(3-methyl-4-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine
CID 114701017
N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine
CID 83834295

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine?
The IUPAC name of 4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine (CID 161392190) is 4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine.
What is the SMILES notation for 4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine?
The canonical SMILES for 4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine is CC(C)c1ccncc1.CN(C)c1cc(C(C)(C)C)ccn1.Cc1cc(C(C)C)cc(C)n1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)nc(C)n1.
What is the InChIKey of 4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine?
The InChIKey is VTDBJSSEAKTYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2.C10H15N.C9H14N2.C9H13N.C8H11N/c1-11(2,3)9-6-7-12-10(8-9)13(4)5;1-7(2)10-5-8(3)11-9(4)6-10;1-6(2)9-5-7(3)10-8(4)11-9;1-7(2)9-4-5-10-8(3)6-9;1-7(2)8-3-5-9-6-4-8/h6-8H,1-5H3;5-7H,1-4H3;5-6H,1-4H3;4-7H,1-3H3;3-7H,1-2H3.
What are the key properties of 4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine?
4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine has a molecular weight of 734.13 g/mol, XLogP of 12.20, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N,N-dimethylpyridin-2-amine;2,6-dimethyl-4-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyrimidine;2-methyl-4-propan-2-ylpyridine;4-propan-2-ylpyridine is sourced from PubChem (CID 161392190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).