5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide

C14H24N4O — CID 106628456

IUPAC5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide
SMILESCCCN(CC1CCCNC1)C(=O)c1cc(C)[nH]n1
InChIInChI=1S/C14H24N4O/c1-3-7-18(10-12-5-4-6-15-9-12)14(19)13-8-11(2)16-17-13/h8,12,15H,3-7,9-10H2,1-2H3,(H,16,17)
InChIKeyORKYEJPIKNGGOQ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.57
Rot. Bonds5

About 5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide

5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide (PubChem CID 106628456) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide
PubChem CID106628456
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide
SMILESCCCN(CC1CCCNC1)C(=O)c1cc(C)[nH]n1
InChIInChI=1S/C14H24N4O/c1-3-7-18(10-12-5-4-6-15-9-12)14(19)13-8-11(2)16-17-13/h8,12,15H,3-7,9-10H2,1-2H3,(H,16,17)
InChIKeyORKYEJPIKNGGOQ-UHFFFAOYSA-N
XLogP1.57
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-N-(piperidin-3-ylmethyl)-N-propylpyridine-2-carboxamide
CID 106628314
N-(piperidin-3-ylmethyl)-N-propyl-1H-1,2,4-triazole-5-carboxamide
CID 106628118
4-bromo-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrrole-2-carboxamide
CID 106628202
5-chloro-N-(piperidin-3-ylmethyl)-N-propylthiophene-2-carboxamide
CID 106628225
2,5-dibromo-N-(piperidin-3-ylmethyl)-N-propylthiophene-3-carboxamide
CID 107963808
ethyl N-(piperidin-3-ylmethyl)-N-propylcarbamate
CID 106630010
2,3-dihydroxy-N-(piperidin-3-ylmethyl)-N-propylbenzamide
CID 106628169
2-fluoro-N-(piperidin-3-ylmethyl)-N-propylbenzamide
CID 106628436
4-fluoro-2-hydroxy-N-(piperidin-3-ylmethyl)-N-propylbenzamide
CID 107016147
4-chloro-3-fluoro-N-(piperidin-3-ylmethyl)-N-propylbenzamide
CID 107990973
N-(piperidin-3-ylmethyl)-N-propylcyclopropanecarboxamide
CID 106628435
1-methyl-N-(piperidin-3-ylmethyl)-N-propylcyclopentane-1-carboxamide
CID 106628384

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide (CID 106628456) is 5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide is CCCN(CC1CCCNC1)C(=O)c1cc(C)[nH]n1.
What is the InChIKey of 5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide?
The InChIKey is ORKYEJPIKNGGOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-7-18(10-12-5-4-6-15-9-12)14(19)13-8-11(2)16-17-13/h8,12,15H,3-7,9-10H2,1-2H3,(H,16,17).
What are the key properties of 5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide?
5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(piperidin-3-ylmethyl)-N-propyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 106628456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).