2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide

C15H31N3O — CID 63760066

IUPAC2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)N(CCN)C1CCCC1
InChIInChI=1S/C15H31N3O/c1-5-15(3,4)17-14(19)12(2)18(11-10-16)13-8-6-7-9-13/h12-13H,5-11,16H2,1-4H3,(H,17,19)
InChIKeyBYWUCYZVATXFDH-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.88
Rot. Bonds7

About 2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide

2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide (PubChem CID 63760066) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide.

Molecular Properties

Compound Name2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide
PubChem CID63760066
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)N(CCN)C1CCCC1
InChIInChI=1S/C15H31N3O/c1-5-15(3,4)17-14(19)12(2)18(11-10-16)13-8-6-7-9-13/h12-13H,5-11,16H2,1-4H3,(H,17,19)
InChIKeyBYWUCYZVATXFDH-UHFFFAOYSA-N
XLogP1.88
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 ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide
CID 102875118
2-[3-aminopropyl(cyclohexyl)amino]-N-tert-butylpropanamide
CID 43137650
2-[(4-aminocyclohexyl)-ethylamino]-N-(2-methylbutan-2-yl)propanamide
CID 79115626
2-[2-aminoethyl(cyclopentyl)amino]-N-(ethylcarbamoyl)propanamide
CID 63761474
2-[2-aminoethyl(methyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 61349502
2-[2-aminoethyl(ethyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 61350485
2-[2-aminoethyl(propan-2-yl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 61350303
2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide
CID 102875071
2-[2-aminoethyl(propyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 61350121
2-[3-aminopropyl(cyclopentyl)amino]-N-propylpropanamide
CID 43137600
2-[3-aminopropyl(cyclohexyl)amino]-N-ethylpropanamide
CID 43137645
2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide
CID 63761281

Frequently Asked Questions

What is the IUPAC name of 2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide?
The IUPAC name of 2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide (CID 63760066) is 2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide.
What is the SMILES notation for 2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide?
The canonical SMILES for 2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide is CCC(C)(C)NC(=O)C(C)N(CCN)C1CCCC1.
What is the InChIKey of 2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide?
The InChIKey is BYWUCYZVATXFDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-5-15(3,4)17-14(19)12(2)18(11-10-16)13-8-6-7-9-13/h12-13H,5-11,16H2,1-4H3,(H,17,19).
What are the key properties of 2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide?
2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide has a molecular weight of 269.43 g/mol, XLogP of 1.88, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide is sourced from PubChem (CID 63760066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).