2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide

C14H27N3O — CID 43137529

IUPAC2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide
SMILESCC(C(=O)NC1CCCC1)N(CCCN)C1CC1
InChIInChI=1S/C14H27N3O/c1-11(14(18)16-12-5-2-3-6-12)17(10-4-9-15)13-7-8-13/h11-13H,2-10,15H2,1H3,(H,16,18)
InChIKeyKFAOSKNYNQMGET-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.25
Rot. Bonds7

About 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide

2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide (PubChem CID 43137529) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide
PubChem CID43137529
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide
SMILESCC(C(=O)NC1CCCC1)N(CCCN)C1CC1
InChIInChI=1S/C14H27N3O/c1-11(14(18)16-12-5-2-3-6-12)17(10-4-9-15)13-7-8-13/h11-13H,2-10,15H2,1H3,(H,16,18)
InChIKeyKFAOSKNYNQMGET-UHFFFAOYSA-N
XLogP1.25
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.25
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(cyclobutyl)amino]-N-propan-2-ylpropanamide
CID 102875071
2-[3-aminopropyl(cyclopropyl)amino]-N-carbamoylpropanamide
CID 43137524
2-[3-aminopropyl(cyclopentyl)amino]-N-propylpropanamide
CID 43137600
2-[(4-aminocyclohexyl)-propylamino]-N-cyclopentylpropanamide
CID 79117291
2-[3-aminopropyl(cyclohexyl)amino]-N-ethylpropanamide
CID 43137645
2-[3-aminopropyl(cyclohexyl)amino]-N-tert-butylpropanamide
CID 43137650
2-[3-aminopropyl(cyclopropyl)amino]-N-pentan-2-ylpropanamide
CID 43137511
2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methoxyethyl)propanamide
CID 43137532
2-[(4-aminocyclohexyl)-ethylamino]-N-cyclohexylpropanamide
CID 79114794
2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 63760066
2-[4-aminobutan-2-yl(methyl)amino]-N-cyclopentylpropanamide
CID 63225297

Frequently Asked Questions

What is the IUPAC name of 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide?
The IUPAC name of 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide (CID 43137529) is 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide.
What is the SMILES notation for 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide?
The canonical SMILES for 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide is CC(C(=O)NC1CCCC1)N(CCCN)C1CC1.
What is the InChIKey of 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide?
The InChIKey is KFAOSKNYNQMGET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-11(14(18)16-12-5-2-3-6-12)17(10-4-9-15)13-7-8-13/h11-13H,2-10,15H2,1H3,(H,16,18).
What are the key properties of 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide?
2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide has a molecular weight of 253.39 g/mol, XLogP of 1.25, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopentylpropanamide is sourced from PubChem (CID 43137529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).