N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide

C13H24N2O — CID 107412683

IUPACN-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide
SMILESCC1CCC(CNCCC(=O)NC2CC2)C1
InChIInChI=1S/C13H24N2O/c1-10-2-3-11(8-10)9-14-7-6-13(16)15-12-4-5-12/h10-12,14H,2-9H2,1H3,(H,15,16)
InChIKeyJYPBUCKMNYHFEC-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.68
Rot. Bonds6

About N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide

N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide (PubChem CID 107412683) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide
PubChem CID107412683
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide
SMILESCC1CCC(CNCCC(=O)NC2CC2)C1
InChIInChI=1S/C13H24N2O/c1-10-2-3-11(8-10)9-14-7-6-13(16)15-12-4-5-12/h10-12,14H,2-9H2,1H3,(H,15,16)
InChIKeyJYPBUCKMNYHFEC-UHFFFAOYSA-N
XLogP1.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.68
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

3-[(3-methylcyclopentyl)methylamino]propanamide
CID 107412716
N-cyclopropyl-3-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
CID 79394765
N-cyclopropyl-3-(octylamino)propanamide
CID 79393740
4-(cyclobutylmethylamino)-N-cyclopropylbutanamide
CID 79393715
N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide
CID 114546265
N,N-dimethyl-4-[(3-methylcyclopentyl)methylamino]butanamide
CID 107412884
3-(tert-butylamino)-N-(4-methylcyclohexyl)propanamide
CID 54928774
N-cyclopropyl-4-[[3-(methylamino)-3-oxopropyl]amino]butanamide
CID 79394133
2-fluoro-N-[(3-methylcyclopentyl)methyl]ethanamine
CID 107412907
3-hydroxy-N-(4-methylcyclohexyl)propanamide
CID 90305092
N-cyclopropyl-3-(2-methylpropylamino)propanamide
CID 62626467
3-(cyanomethylamino)-N-cyclopropylpropanamide
CID 79394850

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide?
The IUPAC name of N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide (CID 107412683) is N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide?
The canonical SMILES for N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide is CC1CCC(CNCCC(=O)NC2CC2)C1.
What is the InChIKey of N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide?
The InChIKey is JYPBUCKMNYHFEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-10-2-3-11(8-10)9-14-7-6-13(16)15-12-4-5-12/h10-12,14H,2-9H2,1H3,(H,15,16).
What are the key properties of N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide?
N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide has a molecular weight of 224.35 g/mol, XLogP of 1.68, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide is sourced from PubChem (CID 107412683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).