N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide

C20H30N4O2 — CID 75473823

IUPACN-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide
SMILESO=C(Nc1cn[nH]c1C1CCCN(C(=O)CCC2CC2)C1)C1CCCC1
InChIInChI=1S/C20H30N4O2/c25-18(10-9-14-7-8-14)24-11-3-6-16(13-24)19-17(12-21-23-19)22-20(26)15-4-1-2-5-15/h12,14-16H,1-11,13H2,(H,21,23)(H,22,26)
InChIKeyNOZCAWOJNBNAJW-UHFFFAOYSA-N
MW358.49 g/mol
LogP3.43
Rot. Bonds6

About N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide

N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide (PubChem CID 75473823) has the molecular formula C20H30N4O2 and a molecular weight of 358.49 g/mol. Its IUPAC name is N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide
PubChem CID75473823
Molecular FormulaC20H30N4O2
Molecular Weight358.49 g/mol
Exact Mass358.24
IUPAC NameN-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide
SMILESO=C(Nc1cn[nH]c1C1CCCN(C(=O)CCC2CC2)C1)C1CCCC1
InChIInChI=1S/C20H30N4O2/c25-18(10-9-14-7-8-14)24-11-3-6-16(13-24)19-17(12-21-23-19)22-20(26)15-4-1-2-5-15/h12,14-16H,1-11,13H2,(H,21,23)(H,22,26)
InChIKeyNOZCAWOJNBNAJW-UHFFFAOYSA-N
XLogP3.43
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide?
The IUPAC name of N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide (CID 75473823) is N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide is O=C(Nc1cn[nH]c1C1CCCN(C(=O)CCC2CC2)C1)C1CCCC1.
What is the InChIKey of N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide?
The InChIKey is NOZCAWOJNBNAJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O2/c25-18(10-9-14-7-8-14)24-11-3-6-16(13-24)19-17(12-21-23-19)22-20(26)15-4-1-2-5-15/h12,14-16H,1-11,13H2,(H,21,23)(H,22,26).
What are the key properties of N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide?
N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide has a molecular weight of 358.49 g/mol, XLogP of 3.43, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[1-(3-cyclopropylpropanoyl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide is sourced from PubChem (CID 75473823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).