(2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide

C13H25N3O — CID 103814111

IUPAC(2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide
SMILESCCN1CCC(CNC(=O)[C@H]2CCCN2)CC1
InChIInChI=1S/C13H25N3O/c1-2-16-8-5-11(6-9-16)10-15-13(17)12-4-3-7-14-12/h11-12,14H,2-10H2,1H3,(H,15,17)/t12-/m1/s1
InChIKeyJHYHIZTUEGWBTD-GFCCVEGCSA-N
MW239.36 g/mol
LogP0.59
Rot. Bonds4

About (2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide

(2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide (PubChem CID 103814111) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is (2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide
PubChem CID103814111
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name(2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide
SMILESCCN1CCC(CNC(=O)[C@H]2CCCN2)CC1
InChIInChI=1S/C13H25N3O/c1-2-16-8-5-11(6-9-16)10-15-13(17)12-4-3-7-14-12/h11-12,14H,2-10H2,1H3,(H,15,17)/t12-/m1/s1
InChIKeyJHYHIZTUEGWBTD-GFCCVEGCSA-N
XLogP0.59
TPSA44.37 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 ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-2-carboxamide
CID 103814109
(2S)-N-[(1-ethylpyrrolidin-3-yl)methyl]piperidine-2-carboxamide
CID 113267408
N-[(4-ethylcyclohexyl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119300473
(2S)-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide;dihydrochloride
CID 119866896
(2R)-N-(1-ethylpiperidin-4-yl)pyrrolidine-2-carboxamide
CID 93469163
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]pyrrolidine-2-carboxamide
CID 54927244
(2S)-N-(thian-4-ylmethyl)pyrrolidine-2-carboxamide
CID 103796007
(2R)-N-(thian-4-ylmethyl)pyrrolidine-2-carboxamide
CID 103796004
N-(cyclooctylmethyl)piperidine-2-carboxamide;hydrochloride
CID 119299438
N-(cyclobutylmethyl)azepane-2-carboxamide
CID 64564563
(2S)-N-[[1-(2-hydroxy-2-phenylethyl)piperidin-4-yl]methyl]pyrrolidine-2-carboxamide
CID 119880550
N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]pyrrolidine-2-carboxamide
CID 119879602

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide (CID 103814111) is (2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide is CCN1CCC(CNC(=O)[C@H]2CCCN2)CC1.
What is the InChIKey of (2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is JHYHIZTUEGWBTD-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H25N3O/c1-2-16-8-5-11(6-9-16)10-15-13(17)12-4-3-7-14-12/h11-12,14H,2-10H2,1H3,(H,15,17)/t12-/m1/s1.
What are the key properties of (2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide?
(2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 0.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1-ethylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 103814111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).