N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride

C11H18ClN3O2 — CID 119603961

IUPACN-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride
SMILESCc1ocnc1C(=O)NC1CCCC1CN.Cl
InChIInChI=1S/C11H17N3O2.ClH/c1-7-10(13-6-16-7)11(15)14-9-4-2-3-8(9)5-12;/h6,8-9H,2-5,12H2,1H3,(H,14,15);1H
InChIKeyHLEIODUDKBBXID-UHFFFAOYSA-N
MW259.74 g/mol
LogP1.26
Rot. Bonds3

About N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride

N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride (PubChem CID 119603961) has the molecular formula C11H18ClN3O2 and a molecular weight of 259.74 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride
PubChem CID119603961
Molecular FormulaC11H18ClN3O2
Molecular Weight259.74 g/mol
Exact Mass259.11
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride
SMILESCc1ocnc1C(=O)NC1CCCC1CN.Cl
InChIInChI=1S/C11H17N3O2.ClH/c1-7-10(13-6-16-7)11(15)14-9-4-2-3-8(9)5-12;/h6,8-9H,2-5,12H2,1H3,(H,14,15);1H
InChIKeyHLEIODUDKBBXID-UHFFFAOYSA-N
XLogP1.26
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.74
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(aminomethyl)cyclopentyl]-5-(4-methylphenyl)-1,3-oxazole-4-carboxamide
CID 119602891
N-[2-(aminomethyl)cyclopentyl]-4-(1,2,4-oxadiazol-3-yl)benzamide;hydrochloride
CID 119604010
N-[2-(aminomethyl)cyclopentyl]-4,6-dimethoxypyrimidine-5-carboxamide;hydrochloride
CID 119602187
N-[2-(aminomethyl)cyclopentyl]-1,3-dimethylpyrazole-4-carboxamide;hydrochloride
CID 119600954
N-[(1S,2R)-2-(aminomethyl)cyclopentyl]benzamide
CID 94903786
N-[2-(aminomethyl)cyclopentyl]-3-fluoro-5-methylbenzamide
CID 113265788
N-[2-(aminomethyl)cyclopentyl]-4-propanoylbenzamide
CID 119603540
N-[2-(aminomethyl)cyclohexyl]-2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119610162
N-[2-(aminomethyl)cyclohexyl]-2,4-dimethyl-1,3-oxazole-5-carboxamide;hydrochloride
CID 119611691
N-[(1R,2S)-2-(aminomethyl)cyclopentyl]-6-methylpyridine-2-carboxamide
CID 139013357
N-[2-(aminomethyl)cyclopentyl]-1-tert-butyl-5-methylpyrazole-4-carboxamide;hydrochloride
CID 119600722
N-[2-(aminomethyl)cyclohexyl]isoquinoline-1-carboxamide;dihydrochloride
CID 119610583

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride (CID 119603961) is N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride is Cc1ocnc1C(=O)NC1CCCC1CN.Cl.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride?
The InChIKey is HLEIODUDKBBXID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2.ClH/c1-7-10(13-6-16-7)11(15)14-9-4-2-3-8(9)5-12;/h6,8-9H,2-5,12H2,1H3,(H,14,15);1H.
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride?
N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride has a molecular weight of 259.74 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-5-methyl-1,3-oxazole-4-carboxamide;hydrochloride is sourced from PubChem (CID 119603961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).