2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide

C15H31N3O — CID 54873886

IUPAC2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide
SMILESCCCCC(N)C(=O)N(CCN(C)C)C1CCCC1
InChIInChI=1S/C15H31N3O/c1-4-5-10-14(16)15(19)18(12-11-17(2)3)13-8-6-7-9-13/h13-14H,4-12,16H2,1-3H3
InChIKeyXGKIGMIKBJZFDL-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.84
Rot. Bonds8

About 2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide

2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide (PubChem CID 54873886) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide.

Molecular Properties

Compound Name2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide
PubChem CID54873886
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide
SMILESCCCCC(N)C(=O)N(CCN(C)C)C1CCCC1
InChIInChI=1S/C15H31N3O/c1-4-5-10-14(16)15(19)18(12-11-17(2)3)13-8-6-7-9-13/h13-14H,4-12,16H2,1-3H3
InChIKeyXGKIGMIKBJZFDL-UHFFFAOYSA-N
XLogP1.84
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-cyclopentyl-N-(3-methylbutyl)hexanamide
CID 103831497
(2S)-2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]butanamide
CID 79024466
(2S)-2-amino-N-cyclopropyl-N-propylhexanamide
CID 103950188
(2S)-2-amino-N-cyclopentyl-N-methylhexanamide
CID 103831134
(2S)-2-amino-N-cyclopropyl-N-(2-hydroxyethyl)hexanamide
CID 103951026
(2R)-2-amino-N-cyclopentyl-N-(3-methylbutyl)pentanamide
CID 103795443
(2S)-2-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methylhexanamide
CID 103831373
2-amino-N-methyl-N-(3-methylcyclohexyl)hexanamide
CID 54949183
2-amino-N-butyl-N-(1,1-dioxothiolan-3-yl)hexanamide
CID 60940048
2-amino-N-cyclopentyl-5-methoxy-N-methylpentanamide
CID 81081449
(2R)-2-amino-N,N-dimethylhexanamide
CID 87696829
(2R)-2-amino-N-cyclobutyl-N-methylpentanamide
CID 103797073

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide?
The IUPAC name of 2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide (CID 54873886) is 2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide.
What is the SMILES notation for 2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide?
The canonical SMILES for 2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide is CCCCC(N)C(=O)N(CCN(C)C)C1CCCC1.
What is the InChIKey of 2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide?
The InChIKey is XGKIGMIKBJZFDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-4-5-10-14(16)15(19)18(12-11-17(2)3)13-8-6-7-9-13/h13-14H,4-12,16H2,1-3H3.
What are the key properties of 2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide?
2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide has a molecular weight of 269.43 g/mol, XLogP of 1.84, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide is sourced from PubChem (CID 54873886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).