[4-(ethylamino)cyclohexyl]urea

C9H19N3O — CID 43653665

IUPAC[4-(ethylamino)cyclohexyl]urea
SMILESCCNC1CCC(NC(N)=O)CC1
InChIInChI=1S/C9H19N3O/c1-2-11-7-3-5-8(6-4-7)12-9(10)13/h7-8,11H,2-6H2,1H3,(H3,10,12,13)
InChIKeyDIBKUPZNEYYKFZ-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.58
Rot. Bonds3

About [4-(ethylamino)cyclohexyl]urea

[4-(ethylamino)cyclohexyl]urea (PubChem CID 43653665) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is [4-(ethylamino)cyclohexyl]urea.

Molecular Properties

Compound Name[4-(ethylamino)cyclohexyl]urea
PubChem CID43653665
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name[4-(ethylamino)cyclohexyl]urea
SMILESCCNC1CCC(NC(N)=O)CC1
InChIInChI=1S/C9H19N3O/c1-2-11-7-3-5-8(6-4-7)12-9(10)13/h7-8,11H,2-6H2,1H3,(H3,10,12,13)
InChIKeyDIBKUPZNEYYKFZ-UHFFFAOYSA-N
XLogP0.58
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(ethylamino)cyclohexyl]cyclopropanecarboxamide
CID 43653371
2-ethyl-N-[4-(ethylamino)cyclohexyl]butanamide
CID 43653291
1,3-bis[4-(carbamoylamino)cyclohexyl]urea
CID 163452854
N-ethylcyclopropanamine;hydrochloride
CID 43810659
1-[4-(ethylamino)cyclohexyl]-1-methylurea
CID 79122178
cyclobutylurea;ethane
CID 145319429
(4-chlorocyclohexyl)urea
CID 86732946
[4-(aminomethyl)cyclohexyl]urea
CID 130538291
N-[4-(ethylamino)cyclohexyl]-3,3,3-trifluoropropanamide
CID 43653338
cyclohexylurea;methanamine
CID 142108304
[4-(dimethylamino)cyclohexyl]urea
CID 59286114
2-[[4-(ethylamino)cyclohexyl]-methylamino]propanamide
CID 79122902

Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)cyclohexyl]urea?
The IUPAC name of [4-(ethylamino)cyclohexyl]urea (CID 43653665) is [4-(ethylamino)cyclohexyl]urea.
What is the SMILES notation for [4-(ethylamino)cyclohexyl]urea?
The canonical SMILES for [4-(ethylamino)cyclohexyl]urea is CCNC1CCC(NC(N)=O)CC1.
What is the InChIKey of [4-(ethylamino)cyclohexyl]urea?
The InChIKey is DIBKUPZNEYYKFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-2-11-7-3-5-8(6-4-7)12-9(10)13/h7-8,11H,2-6H2,1H3,(H3,10,12,13).
What are the key properties of [4-(ethylamino)cyclohexyl]urea?
[4-(ethylamino)cyclohexyl]urea has a molecular weight of 185.27 g/mol, XLogP of 0.58, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)cyclohexyl]urea is sourced from PubChem (CID 43653665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).