1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea

C15H23N3O — CID 43319508

IUPAC1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea
SMILESNCCCN(C(=O)Nc1ccccc1)C1CCCC1
InChIInChI=1S/C15H23N3O/c16-11-6-12-18(14-9-4-5-10-14)15(19)17-13-7-2-1-3-8-13/h1-3,7-8,14H,4-6,9-12,16H2,(H,17,19)
InChIKeyZDJBTJSDTRCVOX-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.81
Rot. Bonds5

About 1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea

1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea (PubChem CID 43319508) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea.

Molecular Properties

Compound Name1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea
PubChem CID43319508
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea
SMILESNCCCN(C(=O)Nc1ccccc1)C1CCCC1
InChIInChI=1S/C15H23N3O/c16-11-6-12-18(14-9-4-5-10-14)15(19)17-13-7-2-1-3-8-13/h1-3,7-8,14H,4-6,9-12,16H2,(H,17,19)
InChIKeyZDJBTJSDTRCVOX-UHFFFAOYSA-N
XLogP2.81
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-aminopropyl)-1-cyclobutyl-3-(3-methoxyphenyl)urea
CID 102874255
1-(3-aminopropyl)-1-cyclopropyl-3-(4-methoxyphenyl)urea
CID 43319501
1-(2-aminoethyl)-1-cyclohexyl-3-(4-fluorophenyl)urea
CID 63766530
1-(3-aminopropyl)-1-cyclopropyl-3-(3-methoxyphenyl)urea
CID 61309564
methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate
CID 115536075
1-[(4-chlorophenyl)methyl]-1-cyclopentyl-3-phenylurea
CID 67700978
3-[4-(aminomethyl)phenyl]-1-cyclobutyl-1-(3-hydroxypropyl)urea
CID 102865027
1-(3-amino-3-sulfanylidenepropyl)-1-cyclopropyl-3-phenylurea
CID 54996612
2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide
CID 63761281
1-cyclohexyl-1-hydroxy-3-phenylurea
CID 86182203
1-[(2-chlorophenyl)methyl]-1-cyclopentyl-3-phenylurea
CID 151779518
N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide
CID 43136808

Frequently Asked Questions

What is the IUPAC name of 1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea?
The IUPAC name of 1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea (CID 43319508) is 1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea.
What is the SMILES notation for 1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea?
The canonical SMILES for 1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea is NCCCN(C(=O)Nc1ccccc1)C1CCCC1.
What is the InChIKey of 1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea?
The InChIKey is ZDJBTJSDTRCVOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c16-11-6-12-18(14-9-4-5-10-14)15(19)17-13-7-2-1-3-8-13/h1-3,7-8,14H,4-6,9-12,16H2,(H,17,19).
What are the key properties of 1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea?
1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea has a molecular weight of 261.37 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea is sourced from PubChem (CID 43319508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).