cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide

C10H19NO — CID 143706762

IUPACcis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide
SMILESCC(C)NC(=O)[C@H]1CCC[C@H]1C
InChIInChI=1S/C10H19NO/c1-7(2)11-10(12)9-6-4-5-8(9)3/h7-9H,4-6H2,1-3H3,(H,11,12)/t8-,9+/m1/s1
InChIKeyGDCLRWWATSLACK-BDAKNGLRSA-N
MW169.27 g/mol
LogP1.95
Rot. Bonds2

About cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide

cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide (PubChem CID 143706762) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide.

Molecular Properties

Compound Namecis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide
PubChem CID143706762
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Namecis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide
SMILESCC(C)NC(=O)[C@H]1CCC[C@H]1C
InChIInChI=1S/C10H19NO/c1-7(2)11-10(12)9-6-4-5-8(9)3/h7-9H,4-6H2,1-3H3,(H,11,12)/t8-,9+/m1/s1
InChIKeyGDCLRWWATSLACK-BDAKNGLRSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;(1R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 143679818
2-methyl-3-[(2-methylcyclopentanecarbonyl)amino]butanoic acid
CID 107175904
4-[(2-methylcyclopentanecarbonyl)amino]pentanoic acid
CID 107175538
cis-(1R,2S)-2-(propan-2-ylcarbamoyl)cyclohexane-1-carboxylic acid
CID 724026
cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide
CID 67437509
3-methyl-2-[(2-methylcyclopentanecarbonyl)amino]pentanoic acid
CID 107175072
N-(1-amino-4-methylpentan-2-yl)-2-methylcyclopentane-1-carboxamide
CID 107180769
N-(1-amino-4-methylpentan-3-yl)-2-methylcyclopentane-1-carboxamide
CID 106356810
trans-(1R,2R)-N-propan-2-yl-2-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 168834989
2-methylsulfanyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 130637655
(2S)-4-methyl-2-[[(1R,2S)-2-methylcyclohexanecarbonyl]amino]pentanoic acid
CID 40965426
(2S)-4-methyl-2-[(2-methylcyclohexanecarbonyl)amino]pentanoic acid
CID 10538955

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide?
The IUPAC name of cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide (CID 143706762) is cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide.
What is the SMILES notation for cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide?
The canonical SMILES for cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide is CC(C)NC(=O)[C@H]1CCC[C@H]1C.
What is the InChIKey of cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide?
The InChIKey is GDCLRWWATSLACK-BDAKNGLRSA-N. The full InChI is InChI=1S/C10H19NO/c1-7(2)11-10(12)9-6-4-5-8(9)3/h7-9H,4-6H2,1-3H3,(H,11,12)/t8-,9+/m1/s1.
What are the key properties of cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide?
cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide has a molecular weight of 169.27 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide is sourced from PubChem (CID 143706762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).