N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine

C19H28FN3 — CID 176692961

IUPACN,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine
SMILESCC(C)c1ccnc(N(C)C)c1.Cc1nccc(C(C)C)c1F
InChIInChI=1S/C10H16N2.C9H12FN/c1-8(2)9-5-6-11-10(7-9)12(3)4;1-6(2)8-4-5-11-7(3)9(8)10/h5-8H,1-4H3;4-6H,1-3H3
InChIKeyOKKDOJTUXQHWCK-UHFFFAOYSA-N
MW317.45 g/mol
LogP4.92
Rot. Bonds3

About N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine

N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine (PubChem CID 176692961) has the molecular formula C19H28FN3 and a molecular weight of 317.45 g/mol. Its IUPAC name is N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine.

Molecular Properties

Compound NameN,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine
PubChem CID176692961
Molecular FormulaC19H28FN3
Molecular Weight317.45 g/mol
Exact Mass317.23
IUPAC NameN,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine
SMILESCC(C)c1ccnc(N(C)C)c1.Cc1nccc(C(C)C)c1F
InChIInChI=1S/C10H16N2.C9H12FN/c1-8(2)9-5-6-11-10(7-9)12(3)4;1-6(2)8-4-5-11-7(3)9(8)10/h5-8H,1-4H3;4-6H,1-3H3
InChIKeyOKKDOJTUXQHWCK-UHFFFAOYSA-N
XLogP4.92
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.45
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-3-fluoro-4-propan-2-ylpyridine
CID 59849657
N,N,4-trimethylpyridin-2-amine
CID 18797061
2-(1-fluoroethyl)-4-propan-2-ylpyridine;3-fluoro-2-(1-fluoroethyl)-4-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;methane;2-methyl-4-propan-2-ylpyridine
CID 160899457
2-(difluoromethyl)-3-fluoro-4-propan-2-ylpyridine
CID 139525099
4-propan-2-yl-2-(4-propan-2-yl-2-pyridinyl)pyridine
CID 15771889
bis(2-methyl-4-propan-2-ylpyridine);2-propan-2-ylphenol
CID 161345551
4-propan-2-yl-N-pyridin-2-yl-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 173090911
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
N-[(1S)-1-[2-(dimethylamino)-4-pyridinyl]-2-hydroxyethyl]acetamide
CID 175744077
(3-fluoro-2-methyl-4-pyridinyl)-pyridin-2-ylmethanol
CID 141423711
N,N-dimethyl-6,8-di(propan-2-yl)quinolin-2-amine
CID 177282930
3,6-difluoro-2-methyl-4-propan-2-ylpyridine
CID 159755748

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine?
The IUPAC name of N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine (CID 176692961) is N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine.
What is the SMILES notation for N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine?
The canonical SMILES for N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine is CC(C)c1ccnc(N(C)C)c1.Cc1nccc(C(C)C)c1F.
What is the InChIKey of N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine?
The InChIKey is OKKDOJTUXQHWCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2.C9H12FN/c1-8(2)9-5-6-11-10(7-9)12(3)4;1-6(2)8-4-5-11-7(3)9(8)10/h5-8H,1-4H3;4-6H,1-3H3.
What are the key properties of N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine?
N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine has a molecular weight of 317.45 g/mol, XLogP of 4.92, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-propan-2-ylpyridin-2-amine;3-fluoro-2-methyl-4-propan-2-ylpyridine is sourced from PubChem (CID 176692961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).