1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide

C13H27N3O — CID 55037810

IUPAC1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide
SMILESCCN(CC)CCNC(=O)C1(CN)CCCC1
InChIInChI=1S/C13H27N3O/c1-3-16(4-2)10-9-15-12(17)13(11-14)7-5-6-8-13/h3-11,14H2,1-2H3,(H,15,17)
InChIKeyGQUPNWFBYOYZFM-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.96
Rot. Bonds7

About 1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide

1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide (PubChem CID 55037810) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide
PubChem CID55037810
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide
SMILESCCN(CC)CCNC(=O)C1(CN)CCCC1
InChIInChI=1S/C13H27N3O/c1-3-16(4-2)10-9-15-12(17)13(11-14)7-5-6-8-13/h3-11,14H2,1-2H3,(H,15,17)
InChIKeyGQUPNWFBYOYZFM-UHFFFAOYSA-N
XLogP0.96
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide
CID 60867384
4-(aminomethyl)-N-[2-[ethyl(propyl)amino]ethyl]oxane-4-carboxamide;dihydrochloride
CID 120942541
1-(aminomethyl)-N-[3-[methyl(propan-2-yl)amino]propyl]cyclopentane-1-carboxamide
CID 114140196
1-[2-(diethylamino)ethylcarbamoyl]cyclobutane-1-carboxylic acid
CID 62095043
1-(aminomethyl)-N-(3-hydroxybutyl)cyclopentane-1-carboxamide
CID 81489303
1-[[2-(diethylamino)ethylcarbamoylamino]methyl]cyclopentane-1-carboxylic acid
CID 115433944
1-carbamothioyl-N-[2-(diethylamino)ethyl]cyclopropane-1-carboxamide
CID 80592590
1-(aminomethyl)-N-[3-(dimethylamino)propyl]cyclopropane-1-carboxamide
CID 80587383
1-(aminomethyl)-N-[2-(2-methylpropanoylamino)ethyl]cyclobutane-1-carboxamide
CID 115448338
4-[[1-(aminomethyl)cyclopentanecarbonyl]amino]butanoic acid
CID 115435094
1-(aminomethyl)-N-[(1-propylcyclopropyl)methyl]cyclopentane-1-carboxamide
CID 103813043
1-(aminomethyl)-N-(3-methylsulfinylpropyl)cyclopentane-1-carboxamide
CID 115739260

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide (CID 55037810) is 1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide is CCN(CC)CCNC(=O)C1(CN)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide?
The InChIKey is GQUPNWFBYOYZFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-3-16(4-2)10-9-15-12(17)13(11-14)7-5-6-8-13/h3-11,14H2,1-2H3,(H,15,17).
What are the key properties of 1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide?
1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide has a molecular weight of 241.38 g/mol, XLogP of 0.96, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-[2-(diethylamino)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 55037810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).