N-(6-amino-3-pyridinyl)-3-ethylheptanamide

C14H23N3O — CID 119515581

IUPACN-(6-amino-3-pyridinyl)-3-ethylheptanamide
SMILESCCCCC(CC)CC(=O)Nc1ccc(N)nc1
InChIInChI=1S/C14H23N3O/c1-3-5-6-11(4-2)9-14(18)17-12-7-8-13(15)16-10-12/h7-8,10-11H,3-6,9H2,1-2H3,(H2,15,16)(H,17,18)
InChIKeyDOLHKMMFQULHSW-UHFFFAOYSA-N
MW249.36 g/mol
LogP3.21
Rot. Bonds7

About N-(6-amino-3-pyridinyl)-3-ethylheptanamide

N-(6-amino-3-pyridinyl)-3-ethylheptanamide (PubChem CID 119515581) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-3-ethylheptanamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-3-ethylheptanamide
PubChem CID119515581
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-(6-amino-3-pyridinyl)-3-ethylheptanamide
SMILESCCCCC(CC)CC(=O)Nc1ccc(N)nc1
InChIInChI=1S/C14H23N3O/c1-3-5-6-11(4-2)9-14(18)17-12-7-8-13(15)16-10-12/h7-8,10-11H,3-6,9H2,1-2H3,(H2,15,16)(H,17,18)
InChIKeyDOLHKMMFQULHSW-UHFFFAOYSA-N
XLogP3.21
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride
CID 119516110
N-(6-amino-3-pyridinyl)-2-methylpentanamide
CID 62899385
5-N-hexan-2-ylpyridine-2,5-diamine
CID 62198332
N-(6-amino-3-pyridinyl)-N',N'-dipropylpentanediamide
CID 119516549
N-(5-amino-2-methylphenyl)-3-ethylheptanamide;hydrochloride
CID 120568529
3-(aminomethyl)-N-(4-fluorophenyl)pentanamide
CID 81071989
N-(6-amino-3-pyridinyl)-2-ethoxypropanamide
CID 119516288
N-(6-amino-3-pyridinyl)-N',N'-dipropylbutanediamide
CID 119515057
N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride
CID 119515208
N-(6-amino-3-pyridinyl)-N',N'-diethylbutanediamide
CID 119516391
N-(4-aminophenyl)-2-(2-ethylhexoxy)acetamide
CID 43127167
N-(6-amino-3-pyridinyl)-N',N'-diethylpentanediamide;hydrochloride
CID 119515259

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-3-ethylheptanamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-3-ethylheptanamide (CID 119515581) is N-(6-amino-3-pyridinyl)-3-ethylheptanamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-3-ethylheptanamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-3-ethylheptanamide is CCCCC(CC)CC(=O)Nc1ccc(N)nc1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-3-ethylheptanamide?
The InChIKey is DOLHKMMFQULHSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-3-5-6-11(4-2)9-14(18)17-12-7-8-13(15)16-10-12/h7-8,10-11H,3-6,9H2,1-2H3,(H2,15,16)(H,17,18).
What are the key properties of N-(6-amino-3-pyridinyl)-3-ethylheptanamide?
N-(6-amino-3-pyridinyl)-3-ethylheptanamide has a molecular weight of 249.36 g/mol, XLogP of 3.21, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-3-ethylheptanamide is sourced from PubChem (CID 119515581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).