4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide

C11H19N5O — CID 54896614

IUPAC4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide
SMILESCc1[nH]ncc1CNC1CCN(C(N)=O)CC1
InChIInChI=1S/C11H19N5O/c1-8-9(7-14-15-8)6-13-10-2-4-16(5-3-10)11(12)17/h7,10,13H,2-6H2,1H3,(H2,12,17)(H,14,15)
InChIKeyZKIVNEOKMZKOFV-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.35
Rot. Bonds3

About 4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide

4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide (PubChem CID 54896614) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide
PubChem CID54896614
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide
SMILESCc1[nH]ncc1CNC1CCN(C(N)=O)CC1
InChIInChI=1S/C11H19N5O/c1-8-9(7-14-15-8)6-13-10-2-4-16(5-3-10)11(12)17/h7,10,13H,2-6H2,1H3,(H2,12,17)(H,14,15)
InChIKeyZKIVNEOKMZKOFV-UHFFFAOYSA-N
XLogP0.35
TPSA87.04 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide?
The IUPAC name of 4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide (CID 54896614) is 4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide.
What is the SMILES notation for 4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide?
The canonical SMILES for 4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide is Cc1[nH]ncc1CNC1CCN(C(N)=O)CC1.
What is the InChIKey of 4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide?
The InChIKey is ZKIVNEOKMZKOFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-8-9(7-14-15-8)6-13-10-2-4-16(5-3-10)11(12)17/h7,10,13H,2-6H2,1H3,(H2,12,17)(H,14,15).
What are the key properties of 4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide?
4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide has a molecular weight of 237.31 g/mol, XLogP of 0.35, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidine-1-carboxamide is sourced from PubChem (CID 54896614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).