2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide

C16H33N3O — CID 115432203

IUPAC2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide
SMILESCCC(CC)(CN)C(=O)N(CCN(C)C)C1CCCC1
InChIInChI=1S/C16H33N3O/c1-5-16(6-2,13-17)15(20)19(12-11-18(3)4)14-9-7-8-10-14/h14H,5-13,17H2,1-4H3
InChIKeyYNSAVDRQHSCASE-UHFFFAOYSA-N
MW283.46 g/mol
LogP2.08
Rot. Bonds8

About 2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide

2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide (PubChem CID 115432203) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is 2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide
PubChem CID115432203
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC Name2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide
SMILESCCC(CC)(CN)C(=O)N(CCN(C)C)C1CCCC1
InChIInChI=1S/C16H33N3O/c1-5-16(6-2,13-17)15(20)19(12-11-18(3)4)14-9-7-8-10-14/h14H,5-13,17H2,1-4H3
InChIKeyYNSAVDRQHSCASE-UHFFFAOYSA-N
XLogP2.08
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(aminomethyl)-N-(cyclohexylmethyl)-N-cyclopropyl-2-ethylbutanamide
CID 115432159
(2S)-2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]butanamide
CID 79024466
2-(aminomethyl)-N-cyclobutyl-N-(2-hydroxyethyl)-2-methylbutanamide
CID 102861281
2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide
CID 79805247
7-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]heptanamide
CID 60954276
2-(aminomethyl)-1-cyclobutyl-2-ethylbutan-1-one
CID 116603949
2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)-2-methylbutanamide
CID 102861246
2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide
CID 114290173
2-(aminomethyl)-2-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylbutanamide
CID 79314285
2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]hexanamide
CID 54873886
2-(aminomethyl)-2-ethyl-N-methyl-N-(1-propylpiperidin-4-yl)butanamide
CID 115432234
2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)propanamide
CID 61266425

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide?
The IUPAC name of 2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide (CID 115432203) is 2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide.
What is the SMILES notation for 2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide?
The canonical SMILES for 2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide is CCC(CC)(CN)C(=O)N(CCN(C)C)C1CCCC1.
What is the InChIKey of 2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide?
The InChIKey is YNSAVDRQHSCASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-5-16(6-2,13-17)15(20)19(12-11-18(3)4)14-9-7-8-10-14/h14H,5-13,17H2,1-4H3.
What are the key properties of 2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide?
2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide has a molecular weight of 283.46 g/mol, XLogP of 2.08, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide is sourced from PubChem (CID 115432203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).