N-(7-aminoheptyl)-2-methylpropanamide

C11H24N2O — CID 89281092

IUPACN-(7-aminoheptyl)-2-methylpropanamide
SMILESCC(C)C(=O)NCCCCCCCN
InChIInChI=1S/C11H24N2O/c1-10(2)11(14)13-9-7-5-3-4-6-8-12/h10H,3-9,12H2,1-2H3,(H,13,14)
InChIKeyMOMHKMCAPYFULY-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.67
Rot. Bonds8

About N-(7-aminoheptyl)-2-methylpropanamide

N-(7-aminoheptyl)-2-methylpropanamide (PubChem CID 89281092) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is N-(7-aminoheptyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(7-aminoheptyl)-2-methylpropanamide
PubChem CID89281092
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC NameN-(7-aminoheptyl)-2-methylpropanamide
SMILESCC(C)C(=O)NCCCCCCCN
InChIInChI=1S/C11H24N2O/c1-10(2)11(14)13-9-7-5-3-4-6-8-12/h10H,3-9,12H2,1-2H3,(H,13,14)
InChIKeyMOMHKMCAPYFULY-UHFFFAOYSA-N
XLogP1.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-aminopropyl)-2-methylpropanamide;hydrochloride
CID 71757297
N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-methylpropanamide
CID 154982765
N-[3-[3-(3-aminopropylamino)propylamino]propyl]-2-methylpropanamide
CID 154594320
7-amino-N-[2-(2-methylpropanoylamino)ethyl]heptanamide
CID 61249058
6-amino-N-[2-(2-methylpropanoylamino)ethyl]hexanamide
CID 61247753
4-(6-aminohexylamino)-2,3-dimethyl-4-oxobutanoic acid
CID 90278241
(2S)-N-(5-aminopentyl)-3-methoxy-2-methylpropanamide
CID 170069625
2-methyl-N-(6-methylheptyl)propanamide
CID 139441078
2,6-diamino-N-[10-(2,6-diaminohexanoylamino)decyl]hexanamide
CID 4011235
(2S)-2,6-diamino-N-[6-[[(2S)-2,6-diaminohexanoyl]amino]hexyl]hexanamide
CID 100984594
2-methyl-N-[4-(methylamino)butyl]propanamide
CID 134337431
2-methyl-N-(9-methyl-8-oxodecyl)propanamide
CID 167573684

Frequently Asked Questions

What is the IUPAC name of N-(7-aminoheptyl)-2-methylpropanamide?
The IUPAC name of N-(7-aminoheptyl)-2-methylpropanamide (CID 89281092) is N-(7-aminoheptyl)-2-methylpropanamide.
What is the SMILES notation for N-(7-aminoheptyl)-2-methylpropanamide?
The canonical SMILES for N-(7-aminoheptyl)-2-methylpropanamide is CC(C)C(=O)NCCCCCCCN.
What is the InChIKey of N-(7-aminoheptyl)-2-methylpropanamide?
The InChIKey is MOMHKMCAPYFULY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-10(2)11(14)13-9-7-5-3-4-6-8-12/h10H,3-9,12H2,1-2H3,(H,13,14).
What are the key properties of N-(7-aminoheptyl)-2-methylpropanamide?
N-(7-aminoheptyl)-2-methylpropanamide has a molecular weight of 200.33 g/mol, XLogP of 1.67, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-aminoheptyl)-2-methylpropanamide is sourced from PubChem (CID 89281092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).