N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide

C14H24N4O — CID 63131561

IUPACN-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide
SMILESCCCC1(C(=O)NCc2cn[nH]c2C)CCCNC1
InChIInChI=1S/C14H24N4O/c1-3-5-14(6-4-7-15-10-14)13(19)16-8-12-9-17-18-11(12)2/h9,15H,3-8,10H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyVQJVEVCMSNNENA-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.50
Rot. Bonds5

About N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide

N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide (PubChem CID 63131561) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide
PubChem CID63131561
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide
SMILESCCCC1(C(=O)NCc2cn[nH]c2C)CCCNC1
InChIInChI=1S/C14H24N4O/c1-3-5-14(6-4-7-15-10-14)13(19)16-8-12-9-17-18-11(12)2/h9,15H,3-8,10H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyVQJVEVCMSNNENA-UHFFFAOYSA-N
XLogP1.50
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide?
The IUPAC name of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide (CID 63131561) is N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide.
What is the SMILES notation for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide?
The canonical SMILES for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide is CCCC1(C(=O)NCc2cn[nH]c2C)CCCNC1.
What is the InChIKey of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide?
The InChIKey is VQJVEVCMSNNENA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-5-14(6-4-7-15-10-14)13(19)16-8-12-9-17-18-11(12)2/h9,15H,3-8,10H2,1-2H3,(H,16,19)(H,17,18).
What are the key properties of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide?
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.50, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-propylpiperidine-3-carboxamide is sourced from PubChem (CID 63131561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).