N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine

C16H24N4O — CID 60943379

IUPACN-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
SMILESCOC(C)(C)CC(C)Nc1cccnc1-n1ccnc1C
InChIInChI=1S/C16H24N4O/c1-12(11-16(3,4)21-5)19-14-7-6-8-18-15(14)20-10-9-17-13(20)2/h6-10,12,19H,11H2,1-5H3
InChIKeyRFSOTCCSPGZYBB-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.19
Rot. Bonds6

About N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine

N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine (PubChem CID 60943379) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound NameN-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
PubChem CID60943379
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC NameN-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
SMILESCOC(C)(C)CC(C)Nc1cccnc1-n1ccnc1C
InChIInChI=1S/C16H24N4O/c1-12(11-16(3,4)21-5)19-14-7-6-8-18-15(14)20-10-9-17-13(20)2/h6-10,12,19H,11H2,1-5H3
InChIKeyRFSOTCCSPGZYBB-UHFFFAOYSA-N
XLogP3.19
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60945603
N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine
CID 43146991
N-(dicyclopropylmethyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60945201
N-(cyclopropylmethyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 54863456
2-(2-methylimidazol-1-yl)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine
CID 106757565
N-heptyl-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60945336
2-methyl-2-[[[2-(2-methylimidazol-1-yl)-3-pyridinyl]amino]methyl]butan-1-ol
CID 81419902
N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 47254863
N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]ethanesulfonamide
CID 64584172
2-(2-methylimidazol-1-yl)-N-(pyridin-3-ylmethyl)pyridin-3-amine
CID 60944674
2-(2-methylimidazol-1-yl)-N-(3-methylsulfanylpropyl)pyridin-3-amine
CID 54863468
(2R)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]-2-(2-methylpropoxy)propanamide
CID 94821236

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine?
The IUPAC name of N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine (CID 60943379) is N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine.
What is the SMILES notation for N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine?
The canonical SMILES for N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine is COC(C)(C)CC(C)Nc1cccnc1-n1ccnc1C.
What is the InChIKey of N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine?
The InChIKey is RFSOTCCSPGZYBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-12(11-16(3,4)21-5)19-14-7-6-8-18-15(14)20-10-9-17-13(20)2/h6-10,12,19H,11H2,1-5H3.
What are the key properties of N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine?
N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine has a molecular weight of 288.39 g/mol, XLogP of 3.19, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 60943379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).