3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide

C14H17N5O — CID 66008743

IUPAC3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2cccnc2-n2cccn2)C1
InChIInChI=1S/C14H17N5O/c15-11-5-4-10(9-11)14(20)18-12-3-1-6-16-13(12)19-8-2-7-17-19/h1-3,6-8,10-11H,4-5,9,15H2,(H,18,20)
InChIKeyMRRZHNUUCFJEGZ-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.33
Rot. Bonds3

About 3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide

3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide (PubChem CID 66008743) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide
PubChem CID66008743
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2cccnc2-n2cccn2)C1
InChIInChI=1S/C14H17N5O/c15-11-5-4-10(9-11)14(20)18-12-3-1-6-16-13(12)19-8-2-7-17-19/h1-3,6-8,10-11H,4-5,9,15H2,(H,18,20)
InChIKeyMRRZHNUUCFJEGZ-UHFFFAOYSA-N
XLogP1.33
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide (CID 66008743) is 3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide is NC1CCC(C(=O)Nc2cccnc2-n2cccn2)C1.
What is the InChIKey of 3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide?
The InChIKey is MRRZHNUUCFJEGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c15-11-5-4-10(9-11)14(20)18-12-3-1-6-16-13(12)19-8-2-7-17-19/h1-3,6-8,10-11H,4-5,9,15H2,(H,18,20).
What are the key properties of 3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide?
3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.33, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-pyrazol-1-yl-3-pyridinyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 66008743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).