1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide

C14H26N2O — CID 126798055

IUPAC1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide
SMILESCC(CN1CCC(C(N)=O)C1)C1CCCCC1
InChIInChI=1S/C14H26N2O/c1-11(12-5-3-2-4-6-12)9-16-8-7-13(10-16)14(15)17/h11-13H,2-10H2,1H3,(H2,15,17)
InChIKeyYZDFOESQTDWQNC-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.01
Rot. Bonds4

About 1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide

1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide (PubChem CID 126798055) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide
PubChem CID126798055
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide
SMILESCC(CN1CCC(C(N)=O)C1)C1CCCCC1
InChIInChI=1S/C14H26N2O/c1-11(12-5-3-2-4-6-12)9-16-8-7-13(10-16)14(15)17/h11-13H,2-10H2,1H3,(H2,15,17)
InChIKeyYZDFOESQTDWQNC-UHFFFAOYSA-N
XLogP2.01
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 65443827
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CID 23456665
1-(2-hydroxy-3-propan-2-yloxypropyl)piperidine-3-carboxamide
CID 60699960
3-bromo-1-(2-cyclobutylpropyl)pyrrolidine
CID 130804419
6-(2-cycloundecylpropyl)-1-methyl-3,3a,4,5,7,7a-hexahydro-2H-pyrrolo[2,3-c]pyridine
CID 123944575
1-(2-cycloheptylpropyl)piperazine
CID 82509737
1-prop-2-ynylpyrrolidine-3-carboxamide
CID 87958018
1-(3,3,3-trifluoro-2-hydroxypropyl)piperidine-3-carboxamide
CID 63902043
1-(2-chloropropanoyl)piperidine-3-carboxamide
CID 24691104
1-cyclohexylpyrrolidine-3-carboxamide;hydrochloride
CID 67294203
1-(1-propanoylpiperidine-4-carbonyl)piperidine-3-carboxamide
CID 131937805
[2-(aminomethyl)piperidin-1-yl]-[1-(2-methylpropyl)pyrrolidin-3-yl]methanone
CID 126790046

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide?
The IUPAC name of 1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide (CID 126798055) is 1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide is CC(CN1CCC(C(N)=O)C1)C1CCCCC1.
What is the InChIKey of 1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide?
The InChIKey is YZDFOESQTDWQNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-11(12-5-3-2-4-6-12)9-16-8-7-13(10-16)14(15)17/h11-13H,2-10H2,1H3,(H2,15,17).
What are the key properties of 1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide?
1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexylpropyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 126798055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).