3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide

C16H25N3O — CID 119862236

IUPAC3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide
SMILESCN(CCNC(=O)C1CCC(N)C1)Cc1ccccc1
InChIInChI=1S/C16H25N3O/c1-19(12-13-5-3-2-4-6-13)10-9-18-16(20)14-7-8-15(17)11-14/h2-6,14-15H,7-12,17H2,1H3,(H,18,20)
InChIKeyZSZBJDJSOYOYIF-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.36
Rot. Bonds6

About 3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide

3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide (PubChem CID 119862236) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide
PubChem CID119862236
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide
SMILESCN(CCNC(=O)C1CCC(N)C1)Cc1ccccc1
InChIInChI=1S/C16H25N3O/c1-19(12-13-5-3-2-4-6-13)10-9-18-16(20)14-7-8-15(17)11-14/h2-6,14-15H,7-12,17H2,1H3,(H,18,20)
InChIKeyZSZBJDJSOYOYIF-UHFFFAOYSA-N
XLogP1.36
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119862239
3-amino-N-[3-[benzyl(methyl)amino]butyl]cyclopentane-1-carboxamide
CID 119899223
N-[2-[benzyl(methyl)amino]ethyl]pyrrolidine-3-carboxamide
CID 119862283
3-amino-N-[3-[benzyl(methyl)amino]butyl]cyclohexane-1-carboxamide
CID 119899227
N-[3-[benzyl(methyl)amino]propyl]cyclopentanecarboxamide
CID 110461342
1-[(2R)-2-aminopropanoyl]-N-[2-[benzyl(methyl)amino]ethyl]piperidine-4-carboxamide
CID 119894122
3-amino-N-[[2-[(dimethylamino)methyl]phenyl]methyl]cyclopentane-1-carboxamide
CID 66010662
1-[2-[benzyl(methyl)amino]ethyl]-2-(cyclobutylmethyl)guanidine
CID 111078743
3-amino-N-[3-(2-fluoro-N-methylanilino)propyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119861519
3-amino-N-benzyl-N-propan-2-ylcyclopentane-1-carboxamide;hydrochloride
CID 119676287
N-[3-[benzyl(methyl)amino]propyl]-1-(cyclopropanecarbonyl)piperidine-4-carboxamide
CID 55529899
N-[2-[benzyl(methyl)amino]ethyl]-1-(6-piperidin-1-ylpyridazin-3-yl)piperidine-4-carboxamide
CID 50772057

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide (CID 119862236) is 3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide is CN(CCNC(=O)C1CCC(N)C1)Cc1ccccc1.
What is the InChIKey of 3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide?
The InChIKey is ZSZBJDJSOYOYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-19(12-13-5-3-2-4-6-13)10-9-18-16(20)14-7-8-15(17)11-14/h2-6,14-15H,7-12,17H2,1H3,(H,18,20).
What are the key properties of 3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide?
3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-[benzyl(methyl)amino]ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119862236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).