N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride

C11H20Cl2N4O — CID 119567226

IUPACN-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride
SMILESCl.Cl.NCC1(NC(=O)Cn2cccn2)CCCC1
InChIInChI=1S/C11H18N4O.2ClH/c12-9-11(4-1-2-5-11)14-10(16)8-15-7-3-6-13-15;;/h3,6-7H,1-2,4-5,8-9,12H2,(H,14,16);2*1H
InChIKeyPEJZLLDOQWWNIF-UHFFFAOYSA-N
MW295.21 g/mol
LogP1.11
Rot. Bonds4

About N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride

N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride (PubChem CID 119567226) has the molecular formula C11H20Cl2N4O and a molecular weight of 295.21 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride
PubChem CID119567226
Molecular FormulaC11H20Cl2N4O
Molecular Weight295.21 g/mol
Exact Mass294.10
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride
SMILESCl.Cl.NCC1(NC(=O)Cn2cccn2)CCCC1
InChIInChI=1S/C11H18N4O.2ClH/c12-9-11(4-1-2-5-11)14-10(16)8-15-7-3-6-13-15;;/h3,6-7H,1-2,4-5,8-9,12H2,(H,14,16);2*1H
InChIKeyPEJZLLDOQWWNIF-UHFFFAOYSA-N
XLogP1.11
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.21
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide
CID 81478484
N-[1-(aminomethyl)cyclopentyl]-2-(2-oxo-1-pyridinyl)acetamide;hydrochloride
CID 119566853
N-[1-(aminomethyl)cyclopentyl]-2-(5-phenyltetrazol-2-yl)acetamide;hydrochloride
CID 119567346
2-(4-aminopyrazol-1-yl)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 55081558
2-[1-[[(2-pyrazol-1-ylacetyl)amino]methyl]cyclobutyl]acetic acid
CID 81165316
2-(3-aminopyrazol-1-yl)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62524961
N-[3-(aminomethyl)pentan-3-yl]-2-pyrazol-1-ylacetamide
CID 63889355
N-[3-(hydroxymethyl)-2,4-dihydrochromen-3-yl]-2-pyrazol-1-ylacetamide
CID 126826752
2-[1-(aminomethyl)cyclohexyl]-N-(2-pyrazol-1-ylethyl)acetamide
CID 104678011
N-(2-amino-1-cyclopropylethyl)-2-pyrazol-1-ylacetamide;dihydrochloride
CID 119616076
N-[1-(aminomethyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)propanamide;dihydrochloride
CID 119567445
2-[1-[[2-(2-oxopyrimidin-1-yl)acetyl]amino]cyclohexyl]acetic acid
CID 64670572

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride (CID 119567226) is N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride is Cl.Cl.NCC1(NC(=O)Cn2cccn2)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride?
The InChIKey is PEJZLLDOQWWNIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O.2ClH/c12-9-11(4-1-2-5-11)14-10(16)8-15-7-3-6-13-15;;/h3,6-7H,1-2,4-5,8-9,12H2,(H,14,16);2*1H.
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride?
N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride has a molecular weight of 295.21 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-2-pyrazol-1-ylacetamide;dihydrochloride is sourced from PubChem (CID 119567226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).