cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide

C13H25N3O — CID 123919654

IUPACcis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide
SMILESN[C@H]1CC[C@@H](C(=O)NCCN2CCCCC2)C1
InChIInChI=1S/C13H25N3O/c14-12-5-4-11(10-12)13(17)15-6-9-16-7-2-1-3-8-16/h11-12H,1-10,14H2,(H,15,17)/t11-,12+/m1/s1
InChIKeyKIXRQVAFBXJEPT-NEPJUHHUSA-N
MW239.36 g/mol
LogP0.72
Rot. Bonds4

About cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide

cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide (PubChem CID 123919654) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Namecis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide
PubChem CID123919654
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Namecis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide
SMILESN[C@H]1CC[C@@H](C(=O)NCCN2CCCCC2)C1
InChIInChI=1S/C13H25N3O/c14-12-5-4-11(10-12)13(17)15-6-9-16-7-2-1-3-8-16/h11-12H,1-10,14H2,(H,15,17)/t11-,12+/m1/s1
InChIKeyKIXRQVAFBXJEPT-NEPJUHHUSA-N
XLogP0.72
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-Cyclopentyl-1-(piperazin-1-yl)propan-1-one
CID 767567
4-(Cyclopentanecarbonyl)piperazin-2-one
CID 833668
Cyclopentyl(3,6-diazabicyclo[3.1.1]heptan-3-yl)methanone
CID 89273597
(1S,4R)-2-azabicyclo(2.2.1)heptan-3-one
CID 2734523
2-Azabicyclo(2.2.1)heptan-3-one
CID 13078198
(1R,4S)-2-azabicyclo(2.2.1)heptan-3-one
CID 55250818
N-(2,6-dioxo-3-piperidyl)cyclopentanecarboxamide
CID 65954274
1-Cyclopentanecarbonylpiperazine
CID 15512779
cyclopentyl-[(1R,6S)-3,8-diazabicyclo[4.2.0]octan-8-yl]methanone
CID 97404071
Cyclopentanecarboxylic acid piperidin-4-ylamide
CID 3163332
N-[2-(piperazin-1-yl)ethyl]cyclopentanecarboxamide
CID 43600321
rac-(1R,3S)-3-(piperidine-1-carbonyl)cyclopentan-1-amine hydrochloride
CID 165817657

Frequently Asked Questions

What is the IUPAC name of cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide?
The IUPAC name of cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide (CID 123919654) is cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide?
The canonical SMILES for cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide is N[C@H]1CC[C@@H](C(=O)NCCN2CCCCC2)C1.
What is the InChIKey of cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide?
The InChIKey is KIXRQVAFBXJEPT-NEPJUHHUSA-N. The full InChI is InChI=1S/C13H25N3O/c14-12-5-4-11(10-12)13(17)15-6-9-16-7-2-1-3-8-16/h11-12H,1-10,14H2,(H,15,17)/t11-,12+/m1/s1.
What are the key properties of cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide?
cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 0.72, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3S)-3-amino-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 123919654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).