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

C16H24N4 — CID 60945603

IUPACN-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine
SMILESCCCC(CCC)Nc1cccnc1-n1ccnc1C
InChIInChI=1S/C16H24N4/c1-4-7-14(8-5-2)19-15-9-6-10-18-16(15)20-12-11-17-13(20)3/h6,9-12,14,19H,4-5,7-8H2,1-3H3
InChIKeyLAZGDZUJBMKIJL-UHFFFAOYSA-N
MW272.40 g/mol
LogP3.96
Rot. Bonds7

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

N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine (PubChem CID 60945603) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound NameN-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine
PubChem CID60945603
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC NameN-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine
SMILESCCCC(CCC)Nc1cccnc1-n1ccnc1C
InChIInChI=1S/C16H24N4/c1-4-7-14(8-5-2)19-15-9-6-10-18-16(15)20-12-11-17-13(20)3/h6,9-12,14,19H,4-5,7-8H2,1-3H3
InChIKeyLAZGDZUJBMKIJL-UHFFFAOYSA-N
XLogP3.96
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-heptan-4-yl-2-methylpyridin-3-amine
CID 79041717
N-heptyl-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60945336
N-(dicyclopropylmethyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60945201
N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]ethanesulfonamide
CID 64584172
N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60943379
2-(2-methylimidazol-1-yl)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine
CID 106757565
N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 47254863
4-hydroxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]pentanamide
CID 79203902
N-cyclopropyl-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 103439170
N-(cyclopropylmethyl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 54863456
2-methyl-2-[[[2-(2-methylimidazol-1-yl)-3-pyridinyl]amino]methyl]butan-1-ol
CID 81419902
2-(methylamino)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 54861926

Frequently Asked Questions

What is the IUPAC name of N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine?
The IUPAC name of N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine (CID 60945603) is N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine.
What is the SMILES notation for N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine?
The canonical SMILES for N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine is CCCC(CCC)Nc1cccnc1-n1ccnc1C.
What is the InChIKey of N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine?
The InChIKey is LAZGDZUJBMKIJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-4-7-14(8-5-2)19-15-9-6-10-18-16(15)20-12-11-17-13(20)3/h6,9-12,14,19H,4-5,7-8H2,1-3H3.
What are the key properties of N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine?
N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine has a molecular weight of 272.40 g/mol, XLogP of 3.96, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-heptan-4-yl-2-(2-methylimidazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 60945603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).