2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide

C12H20N4O — CID 64824492

IUPAC2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide
SMILESCC(Cn1cccn1)NC(=O)C1CCCC1N
InChIInChI=1S/C12H20N4O/c1-9(8-16-7-3-6-14-16)15-12(17)10-4-2-5-11(10)13/h3,6-7,9-11H,2,4-5,8,13H2,1H3,(H,15,17)
InChIKeyWKVDPBMWVMERFA-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.52
Rot. Bonds4

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

2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide (PubChem CID 64824492) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide
PubChem CID64824492
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide
SMILESCC(Cn1cccn1)NC(=O)C1CCCC1N
InChIInChI=1S/C12H20N4O/c1-9(8-16-7-3-6-14-16)15-12(17)10-4-2-5-11(10)13/h3,6-7,9-11H,2,4-5,8,13H2,1H3,(H,15,17)
InChIKeyWKVDPBMWVMERFA-UHFFFAOYSA-N
XLogP0.52
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide (CID 64824492) is 2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide is CC(Cn1cccn1)NC(=O)C1CCCC1N.
What is the InChIKey of 2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide?
The InChIKey is WKVDPBMWVMERFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-9(8-16-7-3-6-14-16)15-12(17)10-4-2-5-11(10)13/h3,6-7,9-11H,2,4-5,8,13H2,1H3,(H,15,17).
What are the key properties of 2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide?
2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide has a molecular weight of 236.32 g/mol, XLogP of 0.52, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 64824492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).