(2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide

C13H24N2O — CID 120635725

IUPAC(2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide
SMILESCCCN(C(=O)[C@H]1CCN[C@@H](C)C1)C1CC1
InChIInChI=1S/C13H24N2O/c1-3-8-15(12-4-5-12)13(16)11-6-7-14-10(2)9-11/h10-12,14H,3-9H2,1-2H3/t10-,11-/m0/s1
InChIKeyHYXFLJXIRIANIE-QWRGUYRKSA-N
MW224.35 g/mol
LogP1.78
Rot. Bonds4

About (2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide

(2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide (PubChem CID 120635725) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is (2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide.

Molecular Properties

Compound Name(2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide
PubChem CID120635725
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name(2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide
SMILESCCCN(C(=O)[C@H]1CCN[C@@H](C)C1)C1CC1
InChIInChI=1S/C13H24N2O/c1-3-8-15(12-4-5-12)13(16)11-6-7-14-10(2)9-11/h10-12,14H,3-9H2,1-2H3/t10-,11-/m0/s1
InChIKeyHYXFLJXIRIANIE-QWRGUYRKSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-N-cyclopropyl-2-methylpiperidine-4-carboxamide
CID 106739366
(2S,4S)-N-cyclopropyl-2-methyl-N-(3-methylbutyl)piperidine-4-carboxamide;hydrochloride
CID 120623080
N-cyclohexyl-N-ethyl-2-methylpiperidine-4-carboxamide
CID 106738612
2-methyl-N-propan-2-yl-N-propylpiperidine-4-carboxamide
CID 106738743
(2S,4S)-N-(cyclopropylmethyl)-2-methyl-N-propylpiperidine-4-carboxamide
CID 120616807
(2S,4S)-N-benzyl-N-cyclopropyl-2-methylpiperidine-4-carboxamide
CID 120619878
(2S,4S)-N-cycloheptyl-N,2-dimethylpiperidine-4-carboxamide
CID 120619148
N-cyclopropyl-2-methyl-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
CID 106739301
(2S,4S)-2-methyl-N,N-bis(3-methylbutyl)piperidine-4-carboxamide
CID 120616325
(2S,4S)-N-butan-2-yl-N,2-dimethylpiperidine-4-carboxamide;hydrochloride
CID 120624137
1-(2-methylpiperidin-4-yl)propan-1-one
CID 165461766
N-(azetidin-3-yl)-N-propylcyclopropanecarboxamide
CID 66181610

Frequently Asked Questions

What is the IUPAC name of (2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide?
The IUPAC name of (2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide (CID 120635725) is (2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide.
What is the SMILES notation for (2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide?
The canonical SMILES for (2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide is CCCN(C(=O)[C@H]1CCN[C@@H](C)C1)C1CC1.
What is the InChIKey of (2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide?
The InChIKey is HYXFLJXIRIANIE-QWRGUYRKSA-N. The full InChI is InChI=1S/C13H24N2O/c1-3-8-15(12-4-5-12)13(16)11-6-7-14-10(2)9-11/h10-12,14H,3-9H2,1-2H3/t10-,11-/m0/s1.
What are the key properties of (2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide?
(2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S)-N-cyclopropyl-2-methyl-N-propylpiperidine-4-carboxamide is sourced from PubChem (CID 120635725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).