2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea

C14H23N5O — CID 83115550

IUPAC2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea
SMILESNC(=O)NCCn1c(C2CCCC2)nc2c1CCNC2
InChIInChI=1S/C14H23N5O/c15-14(20)17-7-8-19-12-5-6-16-9-11(12)18-13(19)10-3-1-2-4-10/h10,16H,1-9H2,(H3,15,17,20)
InChIKeyDNOVKXOKPFARAW-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.85
Rot. Bonds4

About 2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea

2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea (PubChem CID 83115550) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea.

Molecular Properties

Compound Name2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea
PubChem CID83115550
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea
SMILESNC(=O)NCCn1c(C2CCCC2)nc2c1CCNC2
InChIInChI=1S/C14H23N5O/c15-14(20)17-7-8-19-12-5-6-16-9-11(12)18-13(19)10-3-1-2-4-10/h10,16H,1-9H2,(H3,15,17,20)
InChIKeyDNOVKXOKPFARAW-UHFFFAOYSA-N
XLogP0.85
TPSA84.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea?
The IUPAC name of 2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea (CID 83115550) is 2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea.
What is the SMILES notation for 2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea?
The canonical SMILES for 2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea is NC(=O)NCCn1c(C2CCCC2)nc2c1CCNC2.
What is the InChIKey of 2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea?
The InChIKey is DNOVKXOKPFARAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c15-14(20)17-7-8-19-12-5-6-16-9-11(12)18-13(19)10-3-1-2-4-10/h10,16H,1-9H2,(H3,15,17,20).
What are the key properties of 2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea?
2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea has a molecular weight of 277.37 g/mol, XLogP of 0.85, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopentyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethylurea is sourced from PubChem (CID 83115550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).