1-butyl-1,3-dicyclopropylurea

C11H20N2O — CID 115579407

IUPAC1-butyl-1,3-dicyclopropylurea
SMILESCCCCN(C(=O)NC1CC1)C1CC1
InChIInChI=1S/C11H20N2O/c1-2-3-8-13(10-6-7-10)11(14)12-9-4-5-9/h9-10H,2-8H2,1H3,(H,12,14)
InChIKeyFFVLRICSLXYXTL-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.12
Rot. Bonds5

About 1-butyl-1,3-dicyclopropylurea

1-butyl-1,3-dicyclopropylurea (PubChem CID 115579407) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 1-butyl-1,3-dicyclopropylurea.

Molecular Properties

Compound Name1-butyl-1,3-dicyclopropylurea
PubChem CID115579407
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name1-butyl-1,3-dicyclopropylurea
SMILESCCCCN(C(=O)NC1CC1)C1CC1
InChIInChI=1S/C11H20N2O/c1-2-3-8-13(10-6-7-10)11(14)12-9-4-5-9/h9-10H,2-8H2,1H3,(H,12,14)
InChIKeyFFVLRICSLXYXTL-UHFFFAOYSA-N
XLogP2.12
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-[[butyl(cyclopropyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 66030439
1-butyl-1,3-dicyclopropylthiourea
CID 115579485
2-[[butyl(cyclopropyl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 64818273
N-[butyl(cyclopropyl)carbamoyl]-2-chloroacetamide
CID 61444001
3-cyclopropyl-1-propyl-1-pyrrolidin-3-ylurea
CID 62699859
1-butyl-3-cyclopentyl-1-propylurea
CID 108902721
N-[butyl(cyclopropyl)carbamoyl]-3-chloropropanamide
CID 61444003
N-butyl-N-cyclopropylbut-2-enamide
CID 112726716
ethyl 2-[cyclopropyl(cyclopropylcarbamoyl)amino]acetate
CID 62698175
1-(3-aminopropyl)-1-cyclobutyl-3-cyclohexylurea
CID 102874242
4-[[butyl(2-hydroxyethyl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 61447425
3-[cyclooctylcarbamoyl(cyclopropyl)amino]propanoic acid
CID 61181431

Frequently Asked Questions

What is the IUPAC name of 1-butyl-1,3-dicyclopropylurea?
The IUPAC name of 1-butyl-1,3-dicyclopropylurea (CID 115579407) is 1-butyl-1,3-dicyclopropylurea.
What is the SMILES notation for 1-butyl-1,3-dicyclopropylurea?
The canonical SMILES for 1-butyl-1,3-dicyclopropylurea is CCCCN(C(=O)NC1CC1)C1CC1.
What is the InChIKey of 1-butyl-1,3-dicyclopropylurea?
The InChIKey is FFVLRICSLXYXTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-2-3-8-13(10-6-7-10)11(14)12-9-4-5-9/h9-10H,2-8H2,1H3,(H,12,14).
What are the key properties of 1-butyl-1,3-dicyclopropylurea?
1-butyl-1,3-dicyclopropylurea has a molecular weight of 196.29 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-1,3-dicyclopropylurea is sourced from PubChem (CID 115579407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).