(2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide

C14H24N4O — CID 141479982

IUPAC(2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide
SMILESCCCN1CCCC[C@H]1C(=O)Nc1c(C)cnn1C
InChIInChI=1S/C14H24N4O/c1-4-8-18-9-6-5-7-12(18)14(19)16-13-11(2)10-15-17(13)3/h10,12H,4-9H2,1-3H3,(H,16,19)/t12-/m0/s1
InChIKeyOLYNWBKKNPLBLH-LBPRGKRZSA-N
MW264.37 g/mol
LogP1.93
Rot. Bonds4

About (2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide

(2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide (PubChem CID 141479982) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is (2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide
PubChem CID141479982
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name(2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide
SMILESCCCN1CCCC[C@H]1C(=O)Nc1c(C)cnn1C
InChIInChI=1S/C14H24N4O/c1-4-8-18-9-6-5-7-12(18)14(19)16-13-11(2)10-15-17(13)3/h10,12H,4-9H2,1-3H3,(H,16,19)/t12-/m0/s1
InChIKeyOLYNWBKKNPLBLH-LBPRGKRZSA-N
XLogP1.93
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,5-dimethylpiperidin-1-yl)-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 16294137
N-(1-butyl-4-methyl-1H-pyrazol-5-yl)-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 46988576
N-(4-methyl-1-pentan-3-ylpyrazol-5-yl)-2-[(2R)-5-oxopyrrolidin-2-yl]acetamide
CID 52380716
(2S)-N-[1-(3-cyanopropyl)pyrazol-3-yl]-1-propan-2-ylpiperidine-2-carboxamide
CID 97218811
(2S)-2-amino-N-(2-cyclohexylpyrazol-3-yl)propanamide
CID 97789747
N-(1-cyclopentyl-4-methyl-1H-pyrazol-5-yl)-2-(4-methyl-1,4-diazepan-1-yl)acetamide
CID 132406295
N-(4-methyl-1-propyl-1H-pyrazol-5-yl)-2-(2-oxopiperidin-1-yl)acetamide
CID 132409067
N'-(1-butyl-4-methyl-1H-pyrazol-5-yl)-N,N-dimethylsuccinamide
CID 132409856
2-(acetylamino)-N-(1-cyclopentyl-4-methyl-1H-pyrazol-5-yl)acetamide
CID 132410423
5-amino-N-[(3S)-2-oxopiperidin-3-yl]-1-propan-2-ylpyrazole-4-carboxamide
CID 138036938
(2S)-N-(1-ethyl-4-methylpyrazol-5-yl)-2-morpholin-4-ylbutanamide
CID 164633604
(2S)-N-(1-ethyl-4-methylpyrazol-5-yl)-1-methylazepane-2-carboxamide
CID 164639224

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide?
The IUPAC name of (2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide (CID 141479982) is (2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide.
What is the SMILES notation for (2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide?
The canonical SMILES for (2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide is CCCN1CCCC[C@H]1C(=O)Nc1c(C)cnn1C.
What is the InChIKey of (2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide?
The InChIKey is OLYNWBKKNPLBLH-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-8-18-9-6-5-7-12(18)14(19)16-13-11(2)10-15-17(13)3/h10,12H,4-9H2,1-3H3,(H,16,19)/t12-/m0/s1.
What are the key properties of (2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide?
(2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(1,4-dimethylpyrazol-5-yl)-1-propylpiperidine-2-carboxamide is sourced from PubChem (CID 141479982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).