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

C9H18N2O — CID 67437509

IUPACcis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide
SMILESCC(C)NC(=O)[C@@H]1CCC[C@@H]1N
InChIInChI=1S/C9H18N2O/c1-6(2)11-9(12)7-4-3-5-8(7)10/h6-8H,3-5,10H2,1-2H3,(H,11,12)/t7-,8+/m1/s1
InChIKeyMTDVLWNQWAUAFS-SFYZADRCSA-N
MW170.26 g/mol
LogP0.64
Rot. Bonds2

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

cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide (PubChem CID 67437509) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide.

Molecular Properties

Compound Namecis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide
PubChem CID67437509
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Namecis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide
SMILESCC(C)NC(=O)[C@@H]1CCC[C@@H]1N
InChIInChI=1S/C9H18N2O/c1-6(2)11-9(12)7-4-3-5-8(7)10/h6-8H,3-5,10H2,1-2H3,(H,11,12)/t7-,8+/m1/s1
InChIKeyMTDVLWNQWAUAFS-SFYZADRCSA-N
XLogP0.64
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-propan-2-ylcyclooctane-1-carboxamide;hydrochloride
CID 119668927
3-[(2-aminocyclopentanecarbonyl)amino]butanoic acid
CID 64824606
2-amino-N-[(1S)-1-cycloheptylethyl]cycloheptane-1-carboxamide
CID 81392541
2-amino-N-(1-cyanopropan-2-yl)cyclopentane-1-carboxamide
CID 64824063
2-amino-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)cyclopentane-1-carboxamide
CID 112701757
methyl 3-[(2-aminocyclopentanecarbonyl)amino]butanoate
CID 119695162
2-amino-5-methyl-N-propan-2-ylcyclohexane-1-carboxamide
CID 65455850
2-amino-N-[(1S)-1-phenylethyl]cyclopentane-1-carboxamide
CID 64851455
cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 143706762
ethane;(1R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 143679818
2-amino-N-[(1R)-1-(4-chlorophenyl)ethyl]cyclopentane-1-carboxamide
CID 81355221
2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide
CID 64603110

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide?
The IUPAC name of cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide (CID 67437509) is cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide.
What is the SMILES notation for cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide?
The canonical SMILES for cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide is CC(C)NC(=O)[C@@H]1CCC[C@@H]1N.
What is the InChIKey of cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide?
The InChIKey is MTDVLWNQWAUAFS-SFYZADRCSA-N. The full InChI is InChI=1S/C9H18N2O/c1-6(2)11-9(12)7-4-3-5-8(7)10/h6-8H,3-5,10H2,1-2H3,(H,11,12)/t7-,8+/m1/s1.
What are the key properties of cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide?
cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide has a molecular weight of 170.26 g/mol, XLogP of 0.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide is sourced from PubChem (CID 67437509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).