2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide

C15H29N3O — CID 102875118

IUPAC2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide
SMILESCC(C(=O)NC1CCCCC1)N(CCN)C1CCC1
InChIInChI=1S/C15H29N3O/c1-12(18(11-10-16)14-8-5-9-14)15(19)17-13-6-3-2-4-7-13/h12-14H,2-11,16H2,1H3,(H,17,19)
InChIKeyYVOMWISVOJKZKZ-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.64
Rot. Bonds6

About 2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide

2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide (PubChem CID 102875118) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide.

Molecular Properties

Compound Name2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide
PubChem CID102875118
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide
SMILESCC(C(=O)NC1CCCCC1)N(CCN)C1CCC1
InChIInChI=1S/C15H29N3O/c1-12(18(11-10-16)14-8-5-9-14)15(19)17-13-6-3-2-4-7-13/h12-14H,2-11,16H2,1H3,(H,17,19)
InChIKeyYVOMWISVOJKZKZ-UHFFFAOYSA-N
XLogP1.64
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide
CID 43137529
2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 63760066
2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide
CID 79117291
2-[2-aminoethyl(cyclopentyl)amino]-N-(ethylcarbamoyl)propanamide
CID 63761474
2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide
CID 102875071
2-[(4-aminocyclohexyl)-ethylamino]-N-cyclohexylpropanamide
CID 79114794
2-[3-aminopropyl(cyclohexyl)amino]-N-ethylpropanamide
CID 43137645
2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide
CID 63761281
2-[3-aminopropyl(cyclohexyl)amino]-N-tert-butylpropanamide
CID 43137650
2-[3-aminopropyl(cyclopentyl)amino]-N-propylpropanamide
CID 43137600
2-[2-aminoethyl(propan-2-yl)amino]-N-cyclopropylpropanamide
CID 61350106
2-[4-aminobutan-2-yl(methyl)amino]-N-cyclopentylpropanamide
CID 63225297

Frequently Asked Questions

What is the IUPAC name of 2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide?
The IUPAC name of 2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide (CID 102875118) is 2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide.
What is the SMILES notation for 2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide?
The canonical SMILES for 2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide is CC(C(=O)NC1CCCCC1)N(CCN)C1CCC1.
What is the InChIKey of 2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide?
The InChIKey is YVOMWISVOJKZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12(18(11-10-16)14-8-5-9-14)15(19)17-13-6-3-2-4-7-13/h12-14H,2-11,16H2,1H3,(H,17,19).
What are the key properties of 2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide?
2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide has a molecular weight of 267.42 g/mol, XLogP of 1.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide is sourced from PubChem (CID 102875118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).