N-cyclopropyl-2-(octan-4-ylamino)propanamide

C14H28N2O — CID 103728152

IUPACN-cyclopropyl-2-(octan-4-ylamino)propanamide
SMILESCCCCC(CCC)NC(C)C(=O)NC1CC1
InChIInChI=1S/C14H28N2O/c1-4-6-8-12(7-5-2)15-11(3)14(17)16-13-9-10-13/h11-13,15H,4-10H2,1-3H3,(H,16,17)
InChIKeyLKPWFNXBTSGAGB-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.60
Rot. Bonds9

About N-cyclopropyl-2-(octan-4-ylamino)propanamide

N-cyclopropyl-2-(octan-4-ylamino)propanamide (PubChem CID 103728152) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-cyclopropyl-2-(octan-4-ylamino)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(octan-4-ylamino)propanamide
PubChem CID103728152
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-cyclopropyl-2-(octan-4-ylamino)propanamide
SMILESCCCCC(CCC)NC(C)C(=O)NC1CC1
InChIInChI=1S/C14H28N2O/c1-4-6-8-12(7-5-2)15-11(3)14(17)16-13-9-10-13/h11-13,15H,4-10H2,1-3H3,(H,16,17)
InChIKeyLKPWFNXBTSGAGB-UHFFFAOYSA-N
XLogP2.60
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-carbamoyl-2-(octan-4-ylamino)propanamide
CID 113249809
2-(octan-4-ylamino)propanamide
CID 103776431
1-cyclopentyl-3-octan-4-ylurea
CID 103729065
ethyl 2-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]propanoate
CID 61498803
N-cyclopropyl-2-(propan-2-ylamino)propanamide
CID 43085808
2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid
CID 43631930
N-cyclopentyl-2-(3-methylpentan-2-ylamino)propanamide
CID 54950797
(2S,3S)-3-amino-N-cyclopropyl-2-hydroxyheptanamide
CID 50914002
N-cyclopropyl-3-methylhexanamide
CID 155359047
2-(butylamino)-N-cyclopentylpropanamide
CID 43083458
(3S)-N-cyclopropyl-2,3-dihydroxyhexanamide
CID 123542351
N-tert-butyl-2-(heptan-3-ylamino)propanamide
CID 115714332

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(octan-4-ylamino)propanamide?
The IUPAC name of N-cyclopropyl-2-(octan-4-ylamino)propanamide (CID 103728152) is N-cyclopropyl-2-(octan-4-ylamino)propanamide.
What is the SMILES notation for N-cyclopropyl-2-(octan-4-ylamino)propanamide?
The canonical SMILES for N-cyclopropyl-2-(octan-4-ylamino)propanamide is CCCCC(CCC)NC(C)C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(octan-4-ylamino)propanamide?
The InChIKey is LKPWFNXBTSGAGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-6-8-12(7-5-2)15-11(3)14(17)16-13-9-10-13/h11-13,15H,4-10H2,1-3H3,(H,16,17).
What are the key properties of N-cyclopropyl-2-(octan-4-ylamino)propanamide?
N-cyclopropyl-2-(octan-4-ylamino)propanamide has a molecular weight of 240.39 g/mol, XLogP of 2.60, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(octan-4-ylamino)propanamide is sourced from PubChem (CID 103728152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).