4-amino-N-cyclopentyl-N,2-dimethylbutanamide

C11H22N2O — CID 80542011

IUPAC4-amino-N-cyclopentyl-N,2-dimethylbutanamide
SMILESCC(CCN)C(=O)N(C)C1CCCC1
InChIInChI=1S/C11H22N2O/c1-9(7-8-12)11(14)13(2)10-5-3-4-6-10/h9-10H,3-8,12H2,1-2H3
InChIKeyWWVOHWMTXMPOSR-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.37
Rot. Bonds4

About 4-amino-N-cyclopentyl-N,2-dimethylbutanamide

4-amino-N-cyclopentyl-N,2-dimethylbutanamide (PubChem CID 80542011) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 4-amino-N-cyclopentyl-N,2-dimethylbutanamide.

Molecular Properties

Compound Name4-amino-N-cyclopentyl-N,2-dimethylbutanamide
PubChem CID80542011
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name4-amino-N-cyclopentyl-N,2-dimethylbutanamide
SMILESCC(CCN)C(=O)N(C)C1CCCC1
InChIInChI=1S/C11H22N2O/c1-9(7-8-12)11(14)13(2)10-5-3-4-6-10/h9-10H,3-8,12H2,1-2H3
InChIKeyWWVOHWMTXMPOSR-UHFFFAOYSA-N
XLogP1.37
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-cyclohexyl-N,2-dimethylbutanamide
CID 80542163
2-amino-N-cyclooctyl-N-methylpropanamide
CID 83630474
3-(2-aminoethyl)-1-cycloheptyl-1-methylurea
CID 82508731
(2S)-2-amino-N-cyclohexyl-N,3-dimethylbutanamide
CID 61149042
3-chloro-N-cyclopropyl-N,2-dimethylpropanamide
CID 62729219
2-bromo-N-cyclohexyl-N-methylpropanamide
CID 82110244
(2R)-2-amino-N-cyclobutyl-N-methylpentanamide
CID 103797073
5-amino-N-cyclopentyl-2-methyl-N-(3-methylbutyl)pentanamide
CID 104685340
3-[[cyclopentyl(methyl)carbamoyl]amino]-2-methylpropanoic acid
CID 62669199
(2S)-2-amino-N-cyclopentyl-N-methylhexanamide
CID 103831134
3-[cycloheptyl(methyl)amino]-2-methyl-3-oxopropanoic acid
CID 114897396
2-bromo-N-cyclopentyl-N,3-dimethylbutanamide
CID 43267096

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopentyl-N,2-dimethylbutanamide?
The IUPAC name of 4-amino-N-cyclopentyl-N,2-dimethylbutanamide (CID 80542011) is 4-amino-N-cyclopentyl-N,2-dimethylbutanamide.
What is the SMILES notation for 4-amino-N-cyclopentyl-N,2-dimethylbutanamide?
The canonical SMILES for 4-amino-N-cyclopentyl-N,2-dimethylbutanamide is CC(CCN)C(=O)N(C)C1CCCC1.
What is the InChIKey of 4-amino-N-cyclopentyl-N,2-dimethylbutanamide?
The InChIKey is WWVOHWMTXMPOSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9(7-8-12)11(14)13(2)10-5-3-4-6-10/h9-10H,3-8,12H2,1-2H3.
What are the key properties of 4-amino-N-cyclopentyl-N,2-dimethylbutanamide?
4-amino-N-cyclopentyl-N,2-dimethylbutanamide has a molecular weight of 198.31 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopentyl-N,2-dimethylbutanamide is sourced from PubChem (CID 80542011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).