N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide

C12H22N2O2 — CID 111423369

IUPACN-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide
SMILESC=CCN(CCO)CC(=O)NC1CCCC1
InChIInChI=1S/C12H22N2O2/c1-2-7-14(8-9-15)10-12(16)13-11-5-3-4-6-11/h2,11,15H,1,3-10H2,(H,13,16)
InChIKeyOCTVVLQYYRBACG-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.53
Rot. Bonds7

About N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide

N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide (PubChem CID 111423369) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide
PubChem CID111423369
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide
SMILESC=CCN(CCO)CC(=O)NC1CCCC1
InChIInChI=1S/C12H22N2O2/c1-2-7-14(8-9-15)10-12(16)13-11-5-3-4-6-11/h2,11,15H,1,3-10H2,(H,13,16)
InChIKeyOCTVVLQYYRBACG-UHFFFAOYSA-N
XLogP0.53
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-hydroxyethyl(prop-2-enyl)amino]-N-(oxan-4-yl)acetamide
CID 113237467
2-[[2-(cycloheptylamino)-2-oxoethyl]-prop-2-enylamino]acetic acid
CID 79276691
N-cycloheptyl-2-[ethyl(2-hydroxyethyl)amino]acetamide
CID 60685926
2-[[2-(oxan-4-ylamino)-2-oxoethyl]-prop-2-enylamino]acetic acid
CID 79277104
N'-acetyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetohydrazide
CID 115747968
2-[acetyl(prop-2-enyl)amino]-N-cyclohexylacetamide
CID 84572779
3-cyclobutyl-1-(2-hydroxyethyl)-1-prop-2-enylurea
CID 115642253
2-[cyclohexyl(2-hydroxyethyl)amino]-N-cyclopentylacetamide
CID 60694014
3-[carboxymethyl-[2-(cyclopentylamino)-2-oxoethyl]amino]propanoic acid
CID 82327406
N-(2-acetamidoethyl)-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide
CID 113237459
3-[[2-(cyclohexylamino)-2-oxoethyl]-(3-hydroxypropyl)amino]propanoic acid
CID 82326965
3-cyclopentyl-1,1-bis(prop-2-enyl)urea
CID 108902716

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide?
The IUPAC name of N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide (CID 111423369) is N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide is C=CCN(CCO)CC(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide?
The InChIKey is OCTVVLQYYRBACG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-2-7-14(8-9-15)10-12(16)13-11-5-3-4-6-11/h2,11,15H,1,3-10H2,(H,13,16).
What are the key properties of N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide?
N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide has a molecular weight of 226.32 g/mol, XLogP of 0.53, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[2-hydroxyethyl(prop-2-enyl)amino]acetamide is sourced from PubChem (CID 111423369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).