(2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide

C16H24N2O — CID 28827851

IUPAC(2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide
SMILESCc1ccc(C)c(N[C@H](C)C(=O)NC2CCCC2)c1
InChIInChI=1S/C16H24N2O/c1-11-8-9-12(2)15(10-11)17-13(3)16(19)18-14-6-4-5-7-14/h8-10,13-14,17H,4-7H2,1-3H3,(H,18,19)/t13-/m1/s1
InChIKeyKMIVUQJBRHDXJK-CYBMUJFWSA-N
MW260.38 g/mol
LogP3.16
Rot. Bonds4

About (2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide

(2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide (PubChem CID 28827851) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is (2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide.

Molecular Properties

Compound Name(2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide
PubChem CID28827851
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name(2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide
SMILESCc1ccc(C)c(N[C@H](C)C(=O)NC2CCCC2)c1
InChIInChI=1S/C16H24N2O/c1-11-8-9-12(2)15(10-11)17-13(3)16(19)18-14-6-4-5-7-14/h8-10,13-14,17H,4-7H2,1-3H3,(H,18,19)/t13-/m1/s1
InChIKeyKMIVUQJBRHDXJK-CYBMUJFWSA-N
XLogP3.16
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-4-methylanilino)-N-cyclopropylpropanamide
CID 43083917
N-cyclopropyl-2-(2-fluoro-4-methylanilino)propanamide
CID 43088822
N-cyclohexyl-2-(3,5-dimethylanilino)propanamide
CID 43083597
N-cyclopentyl-2-[[3-[[1-(cyclopentylamino)-1-oxopropan-2-yl]carbamoylamino]-4-methylphenyl]carbamoylamino]propanamide
CID 47075790
N-cyclopropyl-2-(4-methylanilino)propanamide
CID 43085895
N-cyclohexyl-2-(2-iodoanilino)propanamide
CID 43083874
2-(4-bromo-2-fluoroanilino)-N-cyclopentylpropanamide
CID 43088713
(2S)-2-(4-bromo-3-methylanilino)-N-cyclohexylpropanamide
CID 7043625
2-(2-cyano-3-methylanilino)-N-cyclohexylpropanamide
CID 107804498
N-cyclohexyl-2,5-dimethylbenzamide
CID 925443
1-cyclooctyl-3-(2,5-dimethylphenyl)thiourea
CID 19650520
N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide
CID 79055402

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide?
The IUPAC name of (2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide (CID 28827851) is (2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide.
What is the SMILES notation for (2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide?
The canonical SMILES for (2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide is Cc1ccc(C)c(N[C@H](C)C(=O)NC2CCCC2)c1.
What is the InChIKey of (2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide?
The InChIKey is KMIVUQJBRHDXJK-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H24N2O/c1-11-8-9-12(2)15(10-11)17-13(3)16(19)18-14-6-4-5-7-14/h8-10,13-14,17H,4-7H2,1-3H3,(H,18,19)/t13-/m1/s1.
What are the key properties of (2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide?
(2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide has a molecular weight of 260.38 g/mol, XLogP of 3.16, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide is sourced from PubChem (CID 28827851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).