2-(1-cyclopentylethylamino)ethylurea

C10H21N3O — CID 83111257

IUPAC2-(1-cyclopentylethylamino)ethylurea
SMILESCC(NCCNC(N)=O)C1CCCC1
InChIInChI=1S/C10H21N3O/c1-8(9-4-2-3-5-9)12-6-7-13-10(11)14/h8-9,12H,2-7H2,1H3,(H3,11,13,14)
InChIKeyGBGYGIXBGIESCC-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.82
Rot. Bonds5

About 2-(1-cyclopentylethylamino)ethylurea

2-(1-cyclopentylethylamino)ethylurea (PubChem CID 83111257) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 2-(1-cyclopentylethylamino)ethylurea.

Molecular Properties

Compound Name2-(1-cyclopentylethylamino)ethylurea
PubChem CID83111257
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name2-(1-cyclopentylethylamino)ethylurea
SMILESCC(NCCNC(N)=O)C1CCCC1
InChIInChI=1S/C10H21N3O/c1-8(9-4-2-3-5-9)12-6-7-13-10(11)14/h8-9,12H,2-7H2,1H3,(H3,11,13,14)
InChIKeyGBGYGIXBGIESCC-UHFFFAOYSA-N
XLogP0.82
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(1-cyclobutylethylamino)ethyl]acetamide
CID 107530057
2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81392535
N-carbamoyl-2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81393673
3-[[(1R)-1-cycloheptylethyl]amino]-N-ethylpropanamide
CID 81392911
N-(1-cyclopentylethyl)propan-1-amine
CID 60819417
N-[(1R)-1-cyclopentylethyl]propan-1-amine
CID 81395735
2-amino-3-[[(1R)-1-cycloheptylethyl]amino]propanamide
CID 103257937
methyl 4-(1-cyclopentylethylamino)butanoate
CID 62632824
N-[(1R)-1-cycloheptylethyl]propan-1-amine
CID 81393503
N'-tert-butyl-N-[(1S)-1-cyclopentylethyl]ethane-1,2-diamine
CID 107445909
3-(1-cyclopentylethylamino)-N-(2-methoxyethyl)propanamide
CID 112700250
2-amino-3-(1-cyclopentylethylamino)propanoic acid
CID 103251923

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentylethylamino)ethylurea?
The IUPAC name of 2-(1-cyclopentylethylamino)ethylurea (CID 83111257) is 2-(1-cyclopentylethylamino)ethylurea.
What is the SMILES notation for 2-(1-cyclopentylethylamino)ethylurea?
The canonical SMILES for 2-(1-cyclopentylethylamino)ethylurea is CC(NCCNC(N)=O)C1CCCC1.
What is the InChIKey of 2-(1-cyclopentylethylamino)ethylurea?
The InChIKey is GBGYGIXBGIESCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-8(9-4-2-3-5-9)12-6-7-13-10(11)14/h8-9,12H,2-7H2,1H3,(H3,11,13,14).
What are the key properties of 2-(1-cyclopentylethylamino)ethylurea?
2-(1-cyclopentylethylamino)ethylurea has a molecular weight of 199.30 g/mol, XLogP of 0.82, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentylethylamino)ethylurea is sourced from PubChem (CID 83111257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).