2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide

C15H30N2O — CID 79861280

IUPAC2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)NC1CCCC1(C)C
InChIInChI=1S/C15H30N2O/c1-5-6-7-11-16-14(18)12(2)17-13-9-8-10-15(13,3)4/h12-13,17H,5-11H2,1-4H3,(H,16,18)
InChIKeyQZPLWHZGJOFGGK-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.85
Rot. Bonds7

About 2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide

2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide (PubChem CID 79861280) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide.

Molecular Properties

Compound Name2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide
PubChem CID79861280
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)NC1CCCC1(C)C
InChIInChI=1S/C15H30N2O/c1-5-6-7-11-16-14(18)12(2)17-13-9-8-10-15(13,3)4/h12-13,17H,5-11H2,1-4H3,(H,16,18)
InChIKeyQZPLWHZGJOFGGK-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-butyl-2-[(2,2-dimethylcyclopentyl)amino]propanamide
CID 79870432
2-[(2,2-dimethylcyclopentyl)amino]-N-pentan-3-ylpropanamide
CID 79861523
2-[(2,2-dimethylcyclohexyl)amino]-N-prop-2-ynylpropanamide
CID 79870047
2-[(2,2-dimethylcyclopentyl)amino]hexanoic acid
CID 103256663
2-[(2,2-dimethylcyclopentyl)amino]-N-methyl-N-propan-2-ylpropanamide
CID 102562972
2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N-pentylpropanamide
CID 115359404
(2S)-2-amino-N-(2,2-dimethylcyclopentyl)hexanamide
CID 103831777
2-[[(1R)-1-cycloheptylethyl]amino]-N-pentylpropanamide
CID 81392391
2-[(1-hydroxycyclopentyl)methylamino]-N-pentylpropanamide
CID 65109318
2-(2-cyclopropylpropylamino)-N-pentylpropanamide
CID 115591539
N-propyl-2-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)amino]propanamide
CID 60664094
2-[(2,2-dimethylcyclohexyl)amino]-N-phenylpropanamide
CID 79870022

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide?
The IUPAC name of 2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide (CID 79861280) is 2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide.
What is the SMILES notation for 2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide?
The canonical SMILES for 2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide is CCCCCNC(=O)C(C)NC1CCCC1(C)C.
What is the InChIKey of 2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide?
The InChIKey is QZPLWHZGJOFGGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-5-6-7-11-16-14(18)12(2)17-13-9-8-10-15(13,3)4/h12-13,17H,5-11H2,1-4H3,(H,16,18).
What are the key properties of 2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide?
2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide has a molecular weight of 254.42 g/mol, XLogP of 2.85, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-dimethylcyclopentyl)amino]-N-pentylpropanamide is sourced from PubChem (CID 79861280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).