1-cyclopropyl-3-(piperidin-2-ylmethyl)urea

C10H19N3O — CID 62700229

IUPAC1-cyclopropyl-3-(piperidin-2-ylmethyl)urea
SMILESO=C(NCC1CCCCN1)NC1CC1
InChIInChI=1S/C10H19N3O/c14-10(13-8-4-5-8)12-7-9-3-1-2-6-11-9/h8-9,11H,1-7H2,(H2,12,13,14)
InChIKeyKIQSWEYHWJQVLZ-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.59
Rot. Bonds3

About 1-cyclopropyl-3-(piperidin-2-ylmethyl)urea

1-cyclopropyl-3-(piperidin-2-ylmethyl)urea (PubChem CID 62700229) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-cyclopropyl-3-(piperidin-2-ylmethyl)urea.

Molecular Properties

Compound Name1-cyclopropyl-3-(piperidin-2-ylmethyl)urea
PubChem CID62700229
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-cyclopropyl-3-(piperidin-2-ylmethyl)urea
SMILESO=C(NCC1CCCCN1)NC1CC1
InChIInChI=1S/C10H19N3O/c14-10(13-8-4-5-8)12-7-9-3-1-2-6-11-9/h8-9,11H,1-7H2,(H2,12,13,14)
InChIKeyKIQSWEYHWJQVLZ-UHFFFAOYSA-N
XLogP0.59
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(piperidin-2-ylmethyl)-3-(thian-3-yl)urea
CID 117234759
[(2S)-piperidin-2-yl]methylcarbamic acid
CID 67090489
N'-cyclopentyl-N-[[(2R)-pyrrolidin-2-yl]methyl]oxamide
CID 167012644
1-tert-butyl-3-(piperidin-2-ylmethyl)urea
CID 43210550
1-(1,1-dioxothian-3-yl)-3-(pyrrolidin-2-ylmethyl)urea
CID 117234755
1-(piperidin-2-ylmethyl)-3-(piperidin-3-ylmethyl)urea
CID 117235098
1-(1-methylpyrrolidin-2-yl)-3-(pyrrolidin-2-ylmethyl)urea
CID 117234833
1-(cyclooctylmethyl)-3-cyclopropylurea
CID 87025156
1-amino-N-(piperidin-2-ylmethyl)cyclopropane-1-carboxamide
CID 130961670
N-(piperidin-2-ylmethyl)bicyclo[3.1.0]hexane-6-carboxamide
CID 81479063
N-cycloheptyl-2-piperidin-2-ylacetamide
CID 43346201
1-(3-hydroxypropyl)-3-(pyrrolidin-2-ylmethyl)urea
CID 117234373

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(piperidin-2-ylmethyl)urea?
The IUPAC name of 1-cyclopropyl-3-(piperidin-2-ylmethyl)urea (CID 62700229) is 1-cyclopropyl-3-(piperidin-2-ylmethyl)urea.
What is the SMILES notation for 1-cyclopropyl-3-(piperidin-2-ylmethyl)urea?
The canonical SMILES for 1-cyclopropyl-3-(piperidin-2-ylmethyl)urea is O=C(NCC1CCCCN1)NC1CC1.
What is the InChIKey of 1-cyclopropyl-3-(piperidin-2-ylmethyl)urea?
The InChIKey is KIQSWEYHWJQVLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c14-10(13-8-4-5-8)12-7-9-3-1-2-6-11-9/h8-9,11H,1-7H2,(H2,12,13,14).
What are the key properties of 1-cyclopropyl-3-(piperidin-2-ylmethyl)urea?
1-cyclopropyl-3-(piperidin-2-ylmethyl)urea has a molecular weight of 197.28 g/mol, XLogP of 0.59, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(piperidin-2-ylmethyl)urea is sourced from PubChem (CID 62700229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).