1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea

C10H19N3O — CID 79886101

IUPAC1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea
SMILESCC1CNCCC1NC(=O)NC1CC1
InChIInChI=1S/C10H19N3O/c1-7-6-11-5-4-9(7)13-10(14)12-8-2-3-8/h7-9,11H,2-6H2,1H3,(H2,12,13,14)
InChIKeyPQJAHOIARUBXMM-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.45
Rot. Bonds2

About 1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea

1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea (PubChem CID 79886101) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea.

Molecular Properties

Compound Name1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea
PubChem CID79886101
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea
SMILESCC1CNCCC1NC(=O)NC1CC1
InChIInChI=1S/C10H19N3O/c1-7-6-11-5-4-9(7)13-10(14)12-8-2-3-8/h7-9,11H,2-6H2,1H3,(H2,12,13,14)
InChIKeyPQJAHOIARUBXMM-UHFFFAOYSA-N
XLogP0.45
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-3-[(3R)-pyrrolidin-3-yl]urea
CID 79686058
1-(1-adamantyl)-3-(3-methylpiperidin-4-yl)urea
CID 79872877
1-pyrrolidin-3-yl-3-[(3R)-pyrrolidin-3-yl]urea
CID 66630468
1-cyclopropyl-3-piperidin-3-ylurea
CID 62699673
N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride
CID 120557474
N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide
CID 120556652
N-(3-methylpiperidin-4-yl)pyrrolidine-1-carboxamide
CID 79886370
1-cyclobutyl-3-pyrrolidin-3-ylurea
CID 116658204
4-[(2-cyclopentylacetyl)amino]-N-(3-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 120555118
N-(3-methylpiperidin-4-yl)-2-phenylacetamide;hydrochloride
CID 120553778
N-(3-methylpiperidin-4-yl)oxane-4-carboxamide
CID 79886712
1-cyclohexyl-3-[(3S)-pyrrolidin-3-yl]urea
CID 79685110

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea?
The IUPAC name of 1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea (CID 79886101) is 1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea.
What is the SMILES notation for 1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea?
The canonical SMILES for 1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea is CC1CNCCC1NC(=O)NC1CC1.
What is the InChIKey of 1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea?
The InChIKey is PQJAHOIARUBXMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-7-6-11-5-4-9(7)13-10(14)12-8-2-3-8/h7-9,11H,2-6H2,1H3,(H2,12,13,14).
What are the key properties of 1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea?
1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea has a molecular weight of 197.28 g/mol, XLogP of 0.45, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea is sourced from PubChem (CID 79886101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).