2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide

C15H31N3O — CID 79667958

IUPAC2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide
SMILESCCN(CC(C)(C)CN)C(C)C(=O)NC1CCCC1
InChIInChI=1S/C15H31N3O/c1-5-18(11-15(3,4)10-16)12(2)14(19)17-13-8-6-7-9-13/h12-13H,5-11,16H2,1-4H3,(H,17,19)
InChIKeyVAVAIZKWEPEBBD-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.74
Rot. Bonds7

About 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide

2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide (PubChem CID 79667958) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide
PubChem CID79667958
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide
SMILESCCN(CC(C)(C)CN)C(C)C(=O)NC1CCCC1
InChIInChI=1S/C15H31N3O/c1-5-18(11-15(3,4)10-16)12(2)14(19)17-13-8-6-7-9-13/h12-13H,5-11,16H2,1-4H3,(H,17,19)
InChIKeyVAVAIZKWEPEBBD-UHFFFAOYSA-N
XLogP1.74
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopropylpropanamide
CID 79661499
2-[(3-amino-2,2-dimethylpropyl)-ethylamino]propanoic acid
CID 79661326
ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate
CID 62026180
2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]-2-methylpropanoic acid
CID 62820612
2-[carboxymethyl-[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 55244223
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide
CID 79651871
2-[4-aminobutan-2-yl(methyl)amino]-N-cyclopentylpropanamide
CID 63225297
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cycloheptylacetamide;hydrochloride
CID 119928901
2-[(3-amino-2,2-dimethylpropyl)-propylamino]-N-cycloheptylacetamide
CID 79665477
3-[[1-(cyclopropylamino)-1-oxopropan-2-yl]-ethylamino]-2-methylpropanoic acid
CID 62853862
1-(3-amino-2,2-dimethylpropyl)-3-cyclopropyl-1-methylurea
CID 79652798
2-[[2-(4-acetamidoanilino)-2-oxoethyl]-ethylamino]-N-cyclopentylpropanamide
CID 51171045

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide?
The IUPAC name of 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide (CID 79667958) is 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide.
What is the SMILES notation for 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide?
The canonical SMILES for 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide is CCN(CC(C)(C)CN)C(C)C(=O)NC1CCCC1.
What is the InChIKey of 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide?
The InChIKey is VAVAIZKWEPEBBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-5-18(11-15(3,4)10-16)12(2)14(19)17-13-8-6-7-9-13/h12-13H,5-11,16H2,1-4H3,(H,17,19).
What are the key properties of 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide?
2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide has a molecular weight of 269.43 g/mol, XLogP of 1.74, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide is sourced from PubChem (CID 79667958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).