N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide

C15H23N5O2 — CID 59733404

IUPACN-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide
SMILESCN1CCC(C(=O)Nc2cn[nH]c2C(=O)NCC2CC2)CC1
InChIInChI=1S/C15H23N5O2/c1-20-6-4-11(5-7-20)14(21)18-12-9-17-19-13(12)15(22)16-8-10-2-3-10/h9-11H,2-8H2,1H3,(H,16,22)(H,17,19)(H,18,21)
InChIKeyRYVZQOLFDQJZQB-UHFFFAOYSA-N
MW305.38 g/mol
LogP0.83
Rot. Bonds5

About N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide

N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide (PubChem CID 59733404) has the molecular formula C15H23N5O2 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide
PubChem CID59733404
Molecular FormulaC15H23N5O2
Molecular Weight305.38 g/mol
Exact Mass305.19
IUPAC NameN-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide
SMILESCN1CCC(C(=O)Nc2cn[nH]c2C(=O)NCC2CC2)CC1
InChIInChI=1S/C15H23N5O2/c1-20-6-4-11(5-7-20)14(21)18-12-9-17-19-13(12)15(22)16-8-10-2-3-10/h9-11H,2-8H2,1H3,(H,16,22)(H,17,19)(H,18,21)
InChIKeyRYVZQOLFDQJZQB-UHFFFAOYSA-N
XLogP0.83
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 50.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide?
The IUPAC name of N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide (CID 59733404) is N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide?
The canonical SMILES for N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide is CN1CCC(C(=O)Nc2cn[nH]c2C(=O)NCC2CC2)CC1.
What is the InChIKey of N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide?
The InChIKey is RYVZQOLFDQJZQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O2/c1-20-6-4-11(5-7-20)14(21)18-12-9-17-19-13(12)15(22)16-8-10-2-3-10/h9-11H,2-8H2,1H3,(H,16,22)(H,17,19)(H,18,21).
What are the key properties of N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide?
N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 0.83, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(cyclopropylmethylcarbamoyl)-1H-pyrazol-4-yl]-1-methylpiperidine-4-carboxamide is sourced from PubChem (CID 59733404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).