cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide

C11H20N2O — CID 122513048

IUPACcis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide
SMILESCN[C@@H]1CC[C@H](C(=O)NC2(C)CC2)C1
InChIInChI=1S/C11H20N2O/c1-11(5-6-11)13-10(14)8-3-4-9(7-8)12-2/h8-9,12H,3-7H2,1-2H3,(H,13,14)/t8-,9+/m0/s1
InChIKeyYBNUKCKFBOOHKC-DTWKUNHWSA-N
MW196.29 g/mol
LogP1.04
Rot. Bonds3

About cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide

cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide (PubChem CID 122513048) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Namecis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide
PubChem CID122513048
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Namecis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide
SMILESCN[C@@H]1CC[C@H](C(=O)NC2(C)CC2)C1
InChIInChI=1S/C11H20N2O/c1-11(5-6-11)13-10(14)8-3-4-9(7-8)12-2/h8-9,12H,3-7H2,1-2H3,(H,13,14)/t8-,9+/m0/s1
InChIKeyYBNUKCKFBOOHKC-DTWKUNHWSA-N
XLogP1.04
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-methylcyclopropyl)cyclopropanecarboxamide
CID 115634337
4-(aminomethyl)-N-(1-methylcyclopropyl)cyclohexane-1-carboxamide
CID 104963781
4-amino-N-(4-methyloxan-4-yl)cyclohexane-1-carboxamide
CID 113491088
cis-methyl (1S,3R)-3-(methylamino)cyclopentane-1-carboxylate
CID 90378778
6-methyl-N-(4-methyloxan-4-yl)piperidine-3-carboxamide
CID 113491136
N-(1-methylcyclopentyl)pyrrolidine-3-carboxamide
CID 63005620
3-[5-(4-bromophenyl)imidazol-1-yl]-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide
CID 123502442
N-(4-methylpiperidin-4-yl)-4-(trifluoromethyl)cyclohexane-1-carboxamide
CID 114696561
N-(4-methylpiperidin-4-yl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 114696233
2-[(1,4-dimethylcyclohexyl)carbamoyl]cyclobutane-1-carboxylic acid
CID 120975804
trans-(1S,2S)-2-methyl-N-(1-methylcyclobutyl)cyclopropane-1-carboxamide
CID 130646724
1-cyclopentyl-3-(1-methylcyclopropyl)urea
CID 115635212

Frequently Asked Questions

What is the IUPAC name of cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide?
The IUPAC name of cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide (CID 122513048) is cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide?
The canonical SMILES for cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide is CN[C@@H]1CC[C@H](C(=O)NC2(C)CC2)C1.
What is the InChIKey of cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide?
The InChIKey is YBNUKCKFBOOHKC-DTWKUNHWSA-N. The full InChI is InChI=1S/C11H20N2O/c1-11(5-6-11)13-10(14)8-3-4-9(7-8)12-2/h8-9,12H,3-7H2,1-2H3,(H,13,14)/t8-,9+/m0/s1.
What are the key properties of cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide?
cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide has a molecular weight of 196.29 g/mol, XLogP of 1.04, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,3R)-3-(methylamino)-N-(1-methylcyclopropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 122513048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).