1-(cyclopropylmethyl)-1-ethyl-3-propylurea

C10H20N2O — CID 115622668

IUPAC1-(cyclopropylmethyl)-1-ethyl-3-propylurea
SMILESCCCNC(=O)N(CC)CC1CC1
InChIInChI=1S/C10H20N2O/c1-3-7-11-10(13)12(4-2)8-9-5-6-9/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyMSNQRCMVXOBUPC-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.84
Rot. Bonds5

About 1-(cyclopropylmethyl)-1-ethyl-3-propylurea

1-(cyclopropylmethyl)-1-ethyl-3-propylurea (PubChem CID 115622668) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-1-ethyl-3-propylurea.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-1-ethyl-3-propylurea
PubChem CID115622668
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-(cyclopropylmethyl)-1-ethyl-3-propylurea
SMILESCCCNC(=O)N(CC)CC1CC1
InChIInChI=1S/C10H20N2O/c1-3-7-11-10(13)12(4-2)8-9-5-6-9/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyMSNQRCMVXOBUPC-UHFFFAOYSA-N
XLogP1.84
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
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

3-(cyclooctylmethyl)-1-(cyclopropylmethyl)-1-ethylurea
CID 86940440
1,1-bis(cyclopropylmethyl)-3,3-diethylurea
CID 115629557
1-(cyclohexylmethyl)-1-methyl-3-propylurea
CID 115583089
4-[[[cyclobutylmethyl(ethyl)carbamoyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 107400130
(2S)-4-[[cyclopropylmethyl(propyl)carbamoyl]amino]-2-hydroxybutanoic acid
CID 107838868
3-[ethyl(propylcarbamoyl)amino]propanoic acid
CID 61007804
1-methyl-1-(oxan-4-ylmethyl)-3-propylurea
CID 110752121
2-[cyclopropylmethyl-[[3-(ethylamino)-3-oxopropyl]carbamoyl]amino]acetic acid
CID 113410869
2-[[[cyclobutylmethyl(ethyl)carbamoyl]amino]methyl]butanoic acid
CID 107400099
1-ethyl-3-propyl-1-prop-2-ynylurea
CID 78970040
1-ethyl-1-(2-ethylbutyl)-3-propylurea
CID 115583094
N-(cyclopropylmethyl)-N-ethyl-2-(methylamino)acetamide
CID 63954155

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-1-ethyl-3-propylurea?
The IUPAC name of 1-(cyclopropylmethyl)-1-ethyl-3-propylurea (CID 115622668) is 1-(cyclopropylmethyl)-1-ethyl-3-propylurea.
What is the SMILES notation for 1-(cyclopropylmethyl)-1-ethyl-3-propylurea?
The canonical SMILES for 1-(cyclopropylmethyl)-1-ethyl-3-propylurea is CCCNC(=O)N(CC)CC1CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-1-ethyl-3-propylurea?
The InChIKey is MSNQRCMVXOBUPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-3-7-11-10(13)12(4-2)8-9-5-6-9/h9H,3-8H2,1-2H3,(H,11,13).
What are the key properties of 1-(cyclopropylmethyl)-1-ethyl-3-propylurea?
1-(cyclopropylmethyl)-1-ethyl-3-propylurea has a molecular weight of 184.28 g/mol, XLogP of 1.84, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-1-ethyl-3-propylurea is sourced from PubChem (CID 115622668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).