1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide

C19H30N4O2 — CID 72923965

IUPAC1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide
SMILESCN(CCCc1cnn(C)c1)C(=O)C1CCC(=O)N(C2CCCC2)C1
InChIInChI=1S/C19H30N4O2/c1-21(11-5-6-15-12-20-22(2)13-15)19(25)16-9-10-18(24)23(14-16)17-7-3-4-8-17/h12-13,16-17H,3-11,14H2,1-2H3
InChIKeyVQHRWJZFHCDCJS-UHFFFAOYSA-N
MW346.48 g/mol
LogP1.99
Rot. Bonds6

About 1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide

1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide (PubChem CID 72923965) has the molecular formula C19H30N4O2 and a molecular weight of 346.48 g/mol. Its IUPAC name is 1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound Name1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide
PubChem CID72923965
Molecular FormulaC19H30N4O2
Molecular Weight346.48 g/mol
Exact Mass346.24
IUPAC Name1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide
SMILESCN(CCCc1cnn(C)c1)C(=O)C1CCC(=O)N(C2CCCC2)C1
InChIInChI=1S/C19H30N4O2/c1-21(11-5-6-15-12-20-22(2)13-15)19(25)16-9-10-18(24)23(14-16)17-7-3-4-8-17/h12-13,16-17H,3-11,14H2,1-2H3
InChIKeyVQHRWJZFHCDCJS-UHFFFAOYSA-N
XLogP1.99
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide?
The IUPAC name of 1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide (CID 72923965) is 1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for 1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide?
The canonical SMILES for 1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide is CN(CCCc1cnn(C)c1)C(=O)C1CCC(=O)N(C2CCCC2)C1.
What is the InChIKey of 1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide?
The InChIKey is VQHRWJZFHCDCJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O2/c1-21(11-5-6-15-12-20-22(2)13-15)19(25)16-9-10-18(24)23(14-16)17-7-3-4-8-17/h12-13,16-17H,3-11,14H2,1-2H3.
What are the key properties of 1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide?
1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide has a molecular weight of 346.48 g/mol, XLogP of 1.99, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 72923965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).