1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide

C13H25N3O — CID 83111018

IUPAC1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide
SMILESCN(C)C1(CNC(=O)C2(N)CCC2)CCCC1
InChIInChI=1S/C13H25N3O/c1-16(2)12(6-3-4-7-12)10-15-11(17)13(14)8-5-9-13/h3-10,14H2,1-2H3,(H,15,17)
InChIKeyQBPMFICDQMNHNW-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.86
Rot. Bonds4

About 1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide

1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide (PubChem CID 83111018) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide
PubChem CID83111018
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide
SMILESCN(C)C1(CNC(=O)C2(N)CCC2)CCCC1
InChIInChI=1S/C13H25N3O/c1-16(2)12(6-3-4-7-12)10-15-11(17)13(14)8-5-9-13/h3-10,14H2,1-2H3,(H,15,17)
InChIKeyQBPMFICDQMNHNW-UHFFFAOYSA-N
XLogP0.86
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]cyclohexane-1-carboxamide
CID 105415997
1-(aminomethyl)-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119830079
N-[[1-(dimethylamino)cyclopentyl]methyl]-3-oxobutanamide
CID 83109875
1-[[1-(dimethylamino)cyclobutyl]methyl]-3-propan-2-ylurea
CID 105408997
N-[[1-(dimethylamino)cyclobutyl]methyl]-2,2-dimethylpropanamide
CID 105420633
3-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]-3-sulfanylidenepropanamide
CID 83109897
4-carbamothioyl-N-[[1-(dimethylamino)cyclobutyl]methyl]oxane-4-carboxamide
CID 105418006
2-[[1-(dimethylamino)cyclopentyl]methylcarbamoylamino]acetic acid
CID 83121587
3-[[1-(dimethylamino)cyclopentyl]methyl]-1,1-diethylurea
CID 113223972
N-[[1-(dimethylamino)cyclobutyl]methyl]-2,2-difluoroacetamide
CID 103516127
N-carbamoyl-2-[[1-(dimethylamino)cyclopentyl]methylamino]acetamide
CID 78915468
3-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylbutanamide
CID 105417065

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide?
The IUPAC name of 1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide (CID 83111018) is 1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide?
The canonical SMILES for 1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide is CN(C)C1(CNC(=O)C2(N)CCC2)CCCC1.
What is the InChIKey of 1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide?
The InChIKey is QBPMFICDQMNHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-16(2)12(6-3-4-7-12)10-15-11(17)13(14)8-5-9-13/h3-10,14H2,1-2H3,(H,15,17).
What are the key properties of 1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide?
1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 0.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide is sourced from PubChem (CID 83111018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).