1-(1-cyclopropylethyl)-1-methyl-3-propylurea

C10H20N2O — CID 115577776

IUPAC1-(1-cyclopropylethyl)-1-methyl-3-propylurea
SMILESCCCNC(=O)N(C)C(C)C1CC1
InChIInChI=1S/C10H20N2O/c1-4-7-11-10(13)12(3)8(2)9-5-6-9/h8-9H,4-7H2,1-3H3,(H,11,13)
InChIKeyVZWAFEHKTOVNTJ-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.84
Rot. Bonds4

About 1-(1-cyclopropylethyl)-1-methyl-3-propylurea

1-(1-cyclopropylethyl)-1-methyl-3-propylurea (PubChem CID 115577776) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-(1-cyclopropylethyl)-1-methyl-3-propylurea.

Molecular Properties

Compound Name1-(1-cyclopropylethyl)-1-methyl-3-propylurea
PubChem CID115577776
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-(1-cyclopropylethyl)-1-methyl-3-propylurea
SMILESCCCNC(=O)N(C)C(C)C1CC1
InChIInChI=1S/C10H20N2O/c1-4-7-11-10(13)12(3)8(2)9-5-6-9/h8-9H,4-7H2,1-3H3,(H,11,13)
InChIKeyVZWAFEHKTOVNTJ-UHFFFAOYSA-N
XLogP1.84
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-4-[[1-cyclopropylethyl(methyl)carbamoyl]amino]-2-hydroxybutanoic acid
CID 107838520
3-[[[1-cyclopropylethyl(methyl)carbamoyl]amino]methyl]pentanoic acid
CID 81069543
3-[2-(4-chlorophenoxy)ethyl]-1-(1-cyclopropylethyl)-1-methylurea
CID 87000163
1-(1-cyclopropylethyl)-3-[2-(2,5-difluorophenyl)ethyl]-1-methylurea
CID 71864833
1-(2-amino-1-cyclopropylethyl)-3-butyl-1-methylurea
CID 116652081
1-(1-cyclopropylethyl)-1-methyl-3-[2-(2-nitrophenyl)ethyl]urea
CID 71867771
2-[1-[[[1-cyclopropylethyl(methyl)carbamoyl]amino]methyl]cyclobutyl]acetic acid
CID 81163012
1-[(1S)-1-cyclopropylethyl]-1-methyl-3-(2-methyl-2-piperidin-1-ylpropyl)urea
CID 52505296
1-(1-cyclopropylethyl)-1-methyl-3-[2-[4-(trifluoromethoxy)phenyl]ethyl]urea
CID 87006788
1-(1-cyanopropan-2-yl)-1-methyl-3-propylurea
CID 63224450
(2S)-2-[[1-cyclopropylethyl(methyl)carbamoyl]amino]-3-methylbutanoic acid
CID 61202510
(2S)-2-[[1-cyclopropylethyl(methyl)carbamoyl]amino]-3-hydroxypropanoic acid
CID 61202887

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylethyl)-1-methyl-3-propylurea?
The IUPAC name of 1-(1-cyclopropylethyl)-1-methyl-3-propylurea (CID 115577776) is 1-(1-cyclopropylethyl)-1-methyl-3-propylurea.
What is the SMILES notation for 1-(1-cyclopropylethyl)-1-methyl-3-propylurea?
The canonical SMILES for 1-(1-cyclopropylethyl)-1-methyl-3-propylurea is CCCNC(=O)N(C)C(C)C1CC1.
What is the InChIKey of 1-(1-cyclopropylethyl)-1-methyl-3-propylurea?
The InChIKey is VZWAFEHKTOVNTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-4-7-11-10(13)12(3)8(2)9-5-6-9/h8-9H,4-7H2,1-3H3,(H,11,13).
What are the key properties of 1-(1-cyclopropylethyl)-1-methyl-3-propylurea?
1-(1-cyclopropylethyl)-1-methyl-3-propylurea has a molecular weight of 184.28 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylethyl)-1-methyl-3-propylurea is sourced from PubChem (CID 115577776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).