1-cyclopropyl-3-piperidin-3-ylurea

C9H17N3O — CID 62699673

IUPAC1-cyclopropyl-3-piperidin-3-ylurea
SMILESO=C(NC1CC1)NC1CCCNC1
InChIInChI=1S/C9H17N3O/c13-9(11-7-3-4-7)12-8-2-1-5-10-6-8/h7-8,10H,1-6H2,(H2,11,12,13)
InChIKeyCDMBBISUWZIXEU-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.20
Rot. Bonds2

About 1-cyclopropyl-3-piperidin-3-ylurea

1-cyclopropyl-3-piperidin-3-ylurea (PubChem CID 62699673) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 1-cyclopropyl-3-piperidin-3-ylurea.

Molecular Properties

Compound Name1-cyclopropyl-3-piperidin-3-ylurea
PubChem CID62699673
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name1-cyclopropyl-3-piperidin-3-ylurea
SMILESO=C(NC1CC1)NC1CCCNC1
InChIInChI=1S/C9H17N3O/c13-9(11-7-3-4-7)12-8-2-1-5-10-6-8/h7-8,10H,1-6H2,(H2,11,12,13)
InChIKeyCDMBBISUWZIXEU-UHFFFAOYSA-N
XLogP0.20
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 116658204
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CID 79685110
1-pyrrolidin-3-yl-3-[(3R)-pyrrolidin-3-yl]urea
CID 66630468
4-(cyclopentanecarbonylamino)-N-piperidin-3-ylcyclohexane-1-carboxamide;hydrochloride
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N-piperidin-3-ylpropanamide
CID 3520588
2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride
CID 53256452
1-butan-2-yl-3-piperidin-3-ylurea
CID 126971340
1-(azepan-3-yl)-3-(oxolan-2-yl)urea
CID 117234826
4-(cyclohexylcarbamoylamino)-N-piperidin-3-ylbutanamide
CID 119425673
1-cyclopropyl-3-[1-(piperidin-3-ylmethyl)pyrrolidin-3-yl]urea
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1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea
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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-piperidin-3-ylurea?
The IUPAC name of 1-cyclopropyl-3-piperidin-3-ylurea (CID 62699673) is 1-cyclopropyl-3-piperidin-3-ylurea.
What is the SMILES notation for 1-cyclopropyl-3-piperidin-3-ylurea?
The canonical SMILES for 1-cyclopropyl-3-piperidin-3-ylurea is O=C(NC1CC1)NC1CCCNC1.
What is the InChIKey of 1-cyclopropyl-3-piperidin-3-ylurea?
The InChIKey is CDMBBISUWZIXEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c13-9(11-7-3-4-7)12-8-2-1-5-10-6-8/h7-8,10H,1-6H2,(H2,11,12,13).
What are the key properties of 1-cyclopropyl-3-piperidin-3-ylurea?
1-cyclopropyl-3-piperidin-3-ylurea has a molecular weight of 183.25 g/mol, XLogP of 0.20, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-piperidin-3-ylurea is sourced from PubChem (CID 62699673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).