3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride

C11H19ClN4O — CID 119727673

IUPAC3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCl.Cn1nccc1CNC(=O)C1CCC(N)C1
InChIInChI=1S/C11H18N4O.ClH/c1-15-10(4-5-14-15)7-13-11(16)8-2-3-9(12)6-8;/h4-5,8-9H,2-3,6-7,12H2,1H3,(H,13,16);1H
InChIKeyDZKZKQRFSRPQOQ-UHFFFAOYSA-N
MW258.75 g/mol
LogP0.59
Rot. Bonds3

About 3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride

3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119727673) has the molecular formula C11H19ClN4O and a molecular weight of 258.75 g/mol. Its IUPAC name is 3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride
PubChem CID119727673
Molecular FormulaC11H19ClN4O
Molecular Weight258.75 g/mol
Exact Mass258.12
IUPAC Name3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCl.Cn1nccc1CNC(=O)C1CCC(N)C1
InChIInChI=1S/C11H18N4O.ClH/c1-15-10(4-5-14-15)7-13-11(16)8-2-3-9(12)6-8;/h4-5,8-9H,2-3,6-7,12H2,1H3,(H,13,16);1H
InChIKeyDZKZKQRFSRPQOQ-UHFFFAOYSA-N
XLogP0.59
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.75
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[(4-bromophenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119702505
4-methyl-2-[(2-methylpyrazol-3-yl)methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 114390996
3-amino-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]cyclopentane-1-carboxamide
CID 66010021
1-cyclopentyl-N-[(2-methylpyrazol-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 86979242
3-amino-N-[(4-bromophenyl)methyl]cyclopentane-1-carboxamide
CID 66030877
3-amino-N-[(4-methylphenyl)methyl]cyclopentane-1-carboxamide
CID 66033053
cis-(1S,3R)-3-amino-N-[(4,6-dimethylpyrimidin-2-yl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 154910286
N-[(2-methylpyrazol-3-yl)methyl]acetamide
CID 19292671
3-amino-N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119755255
4-N-[(2-methylpyrazol-3-yl)methyl]cyclohexane-1,4-diamine
CID 62320335
3-amino-N-[(4-fluorophenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119675799
(1S,6R)-6-[(2-methylpyrazol-3-yl)methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 26871279

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride (CID 119727673) is 3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride is Cl.Cn1nccc1CNC(=O)C1CCC(N)C1.
What is the InChIKey of 3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is DZKZKQRFSRPQOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O.ClH/c1-15-10(4-5-14-15)7-13-11(16)8-2-3-9(12)6-8;/h4-5,8-9H,2-3,6-7,12H2,1H3,(H,13,16);1H.
What are the key properties of 3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride?
3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 258.75 g/mol, XLogP of 0.59, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119727673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).