2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide

C13H27N3O — CID 102875071

IUPAC2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)N(CCCN)C1CCC1
InChIInChI=1S/C13H27N3O/c1-10(2)15-13(17)11(3)16(9-5-8-14)12-6-4-7-12/h10-12H,4-9,14H2,1-3H3,(H,15,17)
InChIKeyFFIHSAXXZWYFGO-UHFFFAOYSA-N
MW241.38 g/mol
LogP1.10
Rot. Bonds7

About 2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide

2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide (PubChem CID 102875071) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide
PubChem CID102875071
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)N(CCCN)C1CCC1
InChIInChI=1S/C13H27N3O/c1-10(2)15-13(17)11(3)16(9-5-8-14)12-6-4-7-12/h10-12H,4-9,14H2,1-3H3,(H,15,17)
InChIKeyFFIHSAXXZWYFGO-UHFFFAOYSA-N
XLogP1.10
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-aminopropyl(cyclopropyl)amino]-N-pentan-2-ylpropanamide
CID 43137511
2-[3-aminopropyl(cyclopentyl)amino]-N-propylpropanamide
CID 43137600
2-[3-aminopropyl(cyclohexyl)amino]-N-ethylpropanamide
CID 43137645
2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide
CID 43137529
2-[3-aminopropyl(cyclohexyl)amino]-N-tert-butylpropanamide
CID 43137650
2-[3-aminopropyl(cyclopropyl)amino]-N-carbamoylpropanamide
CID 43137524
2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide
CID 102875118
2-[(3-amino-3-sulfanylidenepropyl)-cyclopropylamino]-N-propan-2-ylpropanamide
CID 54997575
2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methoxyethyl)propanamide
CID 43137532
2-[cyclobutyl(3-hydroxypropyl)amino]propanehydrazide
CID 102873675
2-[2-aminoethyl(cyclopentyl)amino]-N-(ethylcarbamoyl)propanamide
CID 63761474
2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 63760066

Frequently Asked Questions

What is the IUPAC name of 2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide?
The IUPAC name of 2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide (CID 102875071) is 2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide?
The canonical SMILES for 2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide is CC(C)NC(=O)C(C)N(CCCN)C1CCC1.
What is the InChIKey of 2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide?
The InChIKey is FFIHSAXXZWYFGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-10(2)15-13(17)11(3)16(9-5-8-14)12-6-4-7-12/h10-12H,4-9,14H2,1-3H3,(H,15,17).
What are the key properties of 2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide?
2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide has a molecular weight of 241.38 g/mol, XLogP of 1.10, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide is sourced from PubChem (CID 102875071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).