N-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine

C16H24N4 — CID 63945333

IUPACN-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine
SMILESCCCCC(CC)Nc1ccc(-n2ccnc2C)nc1
InChIInChI=1S/C16H24N4/c1-4-6-7-14(5-2)19-15-8-9-16(18-12-15)20-11-10-17-13(20)3/h8-12,14,19H,4-7H2,1-3H3
InChIKeyJJUQRMNQILDXBU-UHFFFAOYSA-N
MW272.40 g/mol
LogP3.96
Rot. Bonds7

About N-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine

N-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine (PubChem CID 63945333) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is N-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound NameN-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine
PubChem CID63945333
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC NameN-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine
SMILESCCCCC(CC)Nc1ccc(-n2ccnc2C)nc1
InChIInChI=1S/C16H24N4/c1-4-6-7-14(5-2)19-15-8-9-16(18-12-15)20-11-10-17-13(20)3/h8-12,14,19H,4-7H2,1-3H3
InChIKeyJJUQRMNQILDXBU-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

6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine
CID 43748679
N-heptan-3-yl-6-imidazol-1-ylpyridin-3-amine
CID 63945117
N-ethyl-6-(2-methylimidazol-1-yl)pyridin-3-amine
CID 43748706
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]formamide
CID 64992462
N-[(5-methylfuran-2-yl)methyl]-6-(2-methylimidazol-1-yl)pyridin-3-amine
CID 43748655
2-amino-2-ethyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide
CID 79813550
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]pent-4-enamide
CID 90564944
3-amino-4-[[6-(2-methylimidazol-1-yl)-3-pyridinyl]amino]-4-oxobutanoic acid
CID 64896268
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-3-propan-2-yloxypropanamide
CID 87018905
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-2,2-diphenylacetamide
CID 90565042
N-(2,5-dimethylcyclohexyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine
CID 64761065
3-[[[6-(2-methylimidazol-1-yl)-3-pyridinyl]amino]methyl]phenol
CID 43748670

Frequently Asked Questions

What is the IUPAC name of N-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine?
The IUPAC name of N-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine (CID 63945333) is N-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine.
What is the SMILES notation for N-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine?
The canonical SMILES for N-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine is CCCCC(CC)Nc1ccc(-n2ccnc2C)nc1.
What is the InChIKey of N-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine?
The InChIKey is JJUQRMNQILDXBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-4-6-7-14(5-2)19-15-8-9-16(18-12-15)20-11-10-17-13(20)3/h8-12,14,19H,4-7H2,1-3H3.
What are the key properties of N-heptan-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine?
N-heptan-3-yl-6-(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-3-yl-6-(2-methylimidazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 63945333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).