2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide

C11H18N4O — CID 104619076

IUPAC2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide
SMILESCc1cn[nH]c1NC(=O)C1(C)CCCC1N
InChIInChI=1S/C11H18N4O/c1-7-6-13-15-9(7)14-10(16)11(2)5-3-4-8(11)12/h6,8H,3-5,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyJSDDJCLLOQDKBN-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.17
Rot. Bonds2

About 2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide

2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide (PubChem CID 104619076) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide
PubChem CID104619076
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide
SMILESCc1cn[nH]c1NC(=O)C1(C)CCCC1N
InChIInChI=1S/C11H18N4O/c1-7-6-13-15-9(7)14-10(16)11(2)5-3-4-8(11)12/h6,8H,3-5,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyJSDDJCLLOQDKBN-UHFFFAOYSA-N
XLogP1.17
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide (CID 104619076) is 2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide is Cc1cn[nH]c1NC(=O)C1(C)CCCC1N.
What is the InChIKey of 2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide?
The InChIKey is JSDDJCLLOQDKBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-7-6-13-15-9(7)14-10(16)11(2)5-3-4-8(11)12/h6,8H,3-5,12H2,1-2H3,(H2,13,14,15,16).
What are the key properties of 2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide?
2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.17, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-methyl-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 104619076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).