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

C14H25N3O2 — CID 106629708

IUPAC1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea
SMILESO=C(NC1CCOC1)N(CC1CCCCN1)C1CC1
InChIInChI=1S/C14H25N3O2/c18-14(16-12-6-8-19-10-12)17(13-4-5-13)9-11-3-1-2-7-15-11/h11-13,15H,1-10H2,(H,16,18)
InChIKeyOKXQAKLNRVLCMW-UHFFFAOYSA-N
MW267.37 g/mol
LogP1.09
Rot. Bonds4

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

1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea (PubChem CID 106629708) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea.

Molecular Properties

Compound Name1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea
PubChem CID106629708
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea
SMILESO=C(NC1CCOC1)N(CC1CCCCN1)C1CC1
InChIInChI=1S/C14H25N3O2/c18-14(16-12-6-8-19-10-12)17(13-4-5-13)9-11-3-1-2-7-15-11/h11-13,15H,1-10H2,(H,16,18)
InChIKeyOKXQAKLNRVLCMW-UHFFFAOYSA-N
XLogP1.09
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(oxolan-3-yl)-1-propyl-1-(pyrrolidin-2-ylmethyl)urea
CID 106613333
1-(2-methoxyethyl)-3-(oxolan-3-yl)-1-(pyrrolidin-2-ylmethyl)urea
CID 106613461
1-cyclopropyl-1-ethyl-3-(oxolan-3-yl)urea
CID 115760678
1-cyclopropyl-1-(2-methylpropyl)-3-(oxolan-3-yl)urea
CID 115760645
N-cyclopropyl-N-(piperidin-2-ylmethyl)acetamide
CID 66569474
1-cyclopropyl-1-methyl-3-(oxolan-3-yl)urea
CID 115760744
1-(morpholin-3-ylmethyl)-3-(oxolan-3-yl)urea
CID 103548783
N-(oxan-4-yl)-2-(piperidin-2-ylmethoxy)acetamide
CID 63098533
N-cyclopropyl-3-(oxan-3-yl)-N-(pyrrolidin-2-ylmethyl)propanamide
CID 129008000
1,1-dimethyl-3-(oxolan-3-yl)urea
CID 110868817
N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide
CID 106626973
1-cyclopropyl-3-(3-fluorophenyl)-1-(piperidin-2-ylmethyl)urea
CID 106629695

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea?
The IUPAC name of 1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea (CID 106629708) is 1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea.
What is the SMILES notation for 1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea?
The canonical SMILES for 1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea is O=C(NC1CCOC1)N(CC1CCCCN1)C1CC1.
What is the InChIKey of 1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea?
The InChIKey is OKXQAKLNRVLCMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c18-14(16-12-6-8-19-10-12)17(13-4-5-13)9-11-3-1-2-7-15-11/h11-13,15H,1-10H2,(H,16,18).
What are the key properties of 1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea?
1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea has a molecular weight of 267.37 g/mol, XLogP of 1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(oxolan-3-yl)-1-(piperidin-2-ylmethyl)urea is sourced from PubChem (CID 106629708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).