1-amino-3-(dibutylamino)cyclopentane-1-carboxamide

C14H29N3O — CID 79649564

IUPAC1-amino-3-(dibutylamino)cyclopentane-1-carboxamide
SMILESCCCCN(CCCC)C1CCC(N)(C(N)=O)C1
InChIInChI=1S/C14H29N3O/c1-3-5-9-17(10-6-4-2)12-7-8-14(16,11-12)13(15)18/h12H,3-11,16H2,1-2H3,(H2,15,18)
InChIKeyKIFRESHJFZDSMH-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.62
Rot. Bonds8

About 1-amino-3-(dibutylamino)cyclopentane-1-carboxamide

1-amino-3-(dibutylamino)cyclopentane-1-carboxamide (PubChem CID 79649564) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 1-amino-3-(dibutylamino)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-3-(dibutylamino)cyclopentane-1-carboxamide
PubChem CID79649564
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name1-amino-3-(dibutylamino)cyclopentane-1-carboxamide
SMILESCCCCN(CCCC)C1CCC(N)(C(N)=O)C1
InChIInChI=1S/C14H29N3O/c1-3-5-9-17(10-6-4-2)12-7-8-14(16,11-12)13(15)18/h12H,3-11,16H2,1-2H3,(H2,15,18)
InChIKeyKIFRESHJFZDSMH-UHFFFAOYSA-N
XLogP1.62
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-3-[butyl(methyl)amino]cyclohexane-1-carboxamide
CID 79636493
1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide
CID 79649570
1-amino-3-[bis(2-ethoxyethyl)amino]cyclohexane-1-carboxamide
CID 82940436
[1-amino-3-(dibutylamino)cyclopentyl]methanol
CID 79656278
1-amino-3-[bis(3-methylbutyl)amino]cyclohexane-1-carboxamide
CID 107870991
1-amino-3-[3,3-dimethylbutan-2-yl(methyl)amino]cyclopentane-1-carboxamide
CID 79655573
3-[butyl(ethyl)amino]-1-(cyclopropylamino)cyclohexane-1-carboxamide
CID 79636571
3-(dipropylamino)-1-(ethylamino)cyclopentane-1-carboxamide
CID 79650183
methyl 1-amino-3-[methyl(propyl)amino]cyclopentane-1-carboxylate
CID 79650274
1-amino-3-[butan-2-yl(methyl)amino]cyclohexane-1-carboxamide
CID 79636285
methyl 1-amino-3-[butyl(methyl)amino]cyclohexane-1-carboxylate
CID 79636650
1-amino-3-[butan-2-yl(ethyl)amino]cyclohexane-1-carboxamide
CID 79635988

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-(dibutylamino)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-3-(dibutylamino)cyclopentane-1-carboxamide (CID 79649564) is 1-amino-3-(dibutylamino)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-3-(dibutylamino)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-3-(dibutylamino)cyclopentane-1-carboxamide is CCCCN(CCCC)C1CCC(N)(C(N)=O)C1.
What is the InChIKey of 1-amino-3-(dibutylamino)cyclopentane-1-carboxamide?
The InChIKey is KIFRESHJFZDSMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-3-5-9-17(10-6-4-2)12-7-8-14(16,11-12)13(15)18/h12H,3-11,16H2,1-2H3,(H2,15,18).
What are the key properties of 1-amino-3-(dibutylamino)cyclopentane-1-carboxamide?
1-amino-3-(dibutylamino)cyclopentane-1-carboxamide has a molecular weight of 255.41 g/mol, XLogP of 1.62, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(dibutylamino)cyclopentane-1-carboxamide is sourced from PubChem (CID 79649564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).