N-cyclopropyl-4-(nonan-2-ylamino)butanamide

C16H32N2O — CID 79394259

IUPACN-cyclopropyl-4-(nonan-2-ylamino)butanamide
SMILESCCCCCCCC(C)NCCCC(=O)NC1CC1
InChIInChI=1S/C16H32N2O/c1-3-4-5-6-7-9-14(2)17-13-8-10-16(19)18-15-11-12-15/h14-15,17H,3-13H2,1-2H3,(H,18,19)
InChIKeyDDBYKFFGLMMSJV-UHFFFAOYSA-N
MW268.44 g/mol
LogP3.38
Rot. Bonds12

About N-cyclopropyl-4-(nonan-2-ylamino)butanamide

N-cyclopropyl-4-(nonan-2-ylamino)butanamide (PubChem CID 79394259) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-cyclopropyl-4-(nonan-2-ylamino)butanamide.

Molecular Properties

Compound NameN-cyclopropyl-4-(nonan-2-ylamino)butanamide
PubChem CID79394259
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-cyclopropyl-4-(nonan-2-ylamino)butanamide
SMILESCCCCCCCC(C)NCCCC(=O)NC1CC1
InChIInChI=1S/C16H32N2O/c1-3-4-5-6-7-9-14(2)17-13-8-10-16(19)18-15-11-12-15/h14-15,17H,3-13H2,1-2H3,(H,18,19)
InChIKeyDDBYKFFGLMMSJV-UHFFFAOYSA-N
XLogP3.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 53.38
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-cyclopropyl-4-(hexan-2-ylamino)butanamide
CID 79394095
N-cyclopropyl-4-[(N-heptan-2-yl-N'-methylcarbamimidoyl)amino]butanamide
CID 111195048
N-cyclopropyl-4-(1-methylsulfonylpropan-2-ylamino)butanamide
CID 79394021
N-cyclopropyl-4-(1-cyclopropylethylamino)butanamide
CID 79394178
N-(4-hydroxycyclohexyl)dodecanamide
CID 61380713
N-cyclopropyl-4-[[1-oxo-1-(pentan-3-ylamino)propan-2-yl]amino]butanamide
CID 79393960
N-cyclobutylhexadecanamide
CID 67041463
N-cyclobutylicosanamide
CID 10384249
4-(1-cyclohexylethylamino)-N-cyclopropylbutanamide
CID 79394923
N-cyclopropyl-3-(octylamino)propanamide
CID 79393740
N-heptan-2-ylheptan-1-amine
CID 43572726
N-heptan-2-yldodecan-1-amine
CID 63491878

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-(nonan-2-ylamino)butanamide?
The IUPAC name of N-cyclopropyl-4-(nonan-2-ylamino)butanamide (CID 79394259) is N-cyclopropyl-4-(nonan-2-ylamino)butanamide.
What is the SMILES notation for N-cyclopropyl-4-(nonan-2-ylamino)butanamide?
The canonical SMILES for N-cyclopropyl-4-(nonan-2-ylamino)butanamide is CCCCCCCC(C)NCCCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-4-(nonan-2-ylamino)butanamide?
The InChIKey is DDBYKFFGLMMSJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-3-4-5-6-7-9-14(2)17-13-8-10-16(19)18-15-11-12-15/h14-15,17H,3-13H2,1-2H3,(H,18,19).
What are the key properties of N-cyclopropyl-4-(nonan-2-ylamino)butanamide?
N-cyclopropyl-4-(nonan-2-ylamino)butanamide has a molecular weight of 268.44 g/mol, XLogP of 3.38, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-(nonan-2-ylamino)butanamide is sourced from PubChem (CID 79394259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).