7-amino-N-(1-methoxypropan-2-yl)heptanamide

C11H24N2O2 — CID 24700699

IUPAC7-amino-N-(1-methoxypropan-2-yl)heptanamide
SMILESCOCC(C)NC(=O)CCCCCCN
InChIInChI=1S/C11H24N2O2/c1-10(9-15-2)13-11(14)7-5-3-4-6-8-12/h10H,3-9,12H2,1-2H3,(H,13,14)
InChIKeyFHPRXEJKVYNZTH-UHFFFAOYSA-N
MW216.32 g/mol
LogP1.05
Rot. Bonds9

About 7-amino-N-(1-methoxypropan-2-yl)heptanamide

7-amino-N-(1-methoxypropan-2-yl)heptanamide (PubChem CID 24700699) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 7-amino-N-(1-methoxypropan-2-yl)heptanamide.

Molecular Properties

Compound Name7-amino-N-(1-methoxypropan-2-yl)heptanamide
PubChem CID24700699
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name7-amino-N-(1-methoxypropan-2-yl)heptanamide
SMILESCOCC(C)NC(=O)CCCCCCN
InChIInChI=1S/C11H24N2O2/c1-10(9-15-2)13-11(14)7-5-3-4-6-8-12/h10H,3-9,12H2,1-2H3,(H,13,14)
InChIKeyFHPRXEJKVYNZTH-UHFFFAOYSA-N
XLogP1.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-hydroxy-N-(1-methoxypropan-2-yl)pentanamide
CID 79199618
7-amino-N-(4-methoxy-4-methylpentan-2-yl)heptanamide;hydrochloride
CID 119803209
methyl (2S)-2-(6-aminohexanoylamino)-3-methylbutanoate
CID 43707609
5-amino-N-(4-hydroxybutan-2-yl)pentanamide
CID 83177679
N-(6-aminohexan-2-yl)octanamide
CID 123172105
7-amino-N-(5,5-dimethylhexan-2-yl)heptanamide
CID 119796530
7-amino-N-(3-methylbutan-2-yl)heptanamide;hydrochloride
CID 119678384
2-(7-aminoheptanoylamino)-4-methoxybutanoic acid
CID 62478125
6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide
CID 24702267
7-amino-N-(3-methylpentan-2-yl)heptanamide
CID 61464292
N-(4-aminobutan-2-yl)octanamide
CID 62087208
2-(6-aminohexanoylamino)-3-methylbutanoic acid
CID 61157155

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-(1-methoxypropan-2-yl)heptanamide?
The IUPAC name of 7-amino-N-(1-methoxypropan-2-yl)heptanamide (CID 24700699) is 7-amino-N-(1-methoxypropan-2-yl)heptanamide.
What is the SMILES notation for 7-amino-N-(1-methoxypropan-2-yl)heptanamide?
The canonical SMILES for 7-amino-N-(1-methoxypropan-2-yl)heptanamide is COCC(C)NC(=O)CCCCCCN.
What is the InChIKey of 7-amino-N-(1-methoxypropan-2-yl)heptanamide?
The InChIKey is FHPRXEJKVYNZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-10(9-15-2)13-11(14)7-5-3-4-6-8-12/h10H,3-9,12H2,1-2H3,(H,13,14).
What are the key properties of 7-amino-N-(1-methoxypropan-2-yl)heptanamide?
7-amino-N-(1-methoxypropan-2-yl)heptanamide has a molecular weight of 216.32 g/mol, XLogP of 1.05, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-(1-methoxypropan-2-yl)heptanamide is sourced from PubChem (CID 24700699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).