1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide

C12H17NO3 — CID 115182418

IUPAC1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide
SMILESCc1ccc(CCNC(=O)C2(CO)CC2)o1
InChIInChI=1S/C12H17NO3/c1-9-2-3-10(16-9)4-7-13-11(15)12(8-14)5-6-12/h2-3,14H,4-8H2,1H3,(H,13,15)
InChIKeyPZWKGZRXTHUFAK-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.02
Rot. Bonds5

About 1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide

1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide (PubChem CID 115182418) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is 1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide
PubChem CID115182418
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Name1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide
SMILESCc1ccc(CCNC(=O)C2(CO)CC2)o1
InChIInChI=1S/C12H17NO3/c1-9-2-3-10(16-9)4-7-13-11(15)12(8-14)5-6-12/h2-3,14H,4-8H2,1H3,(H,13,15)
InChIKeyPZWKGZRXTHUFAK-UHFFFAOYSA-N
XLogP1.02
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(3,4-dimethylphenyl)ethyl]-1-(hydroxymethyl)cyclopropane-1-carboxamide
CID 115182374
1-(hydroxymethyl)-N-[2-(2-methylphenyl)ethyl]cyclopropane-1-carboxamide
CID 115182408
N-[2-(5-methylfuran-2-yl)ethyl]propanamide
CID 110872482
1-(hydroxymethyl)-N-[2-(2,4,5-trimethylphenyl)ethyl]cyclopropane-1-carboxamide
CID 115182400
[1-[[2-(5-methylfuran-2-yl)ethylamino]methyl]cyclopropyl]methanol
CID 115243693
[1-[[2-(5-methylfuran-2-yl)ethylamino]methyl]cyclobutyl]methanol
CID 115247111
N-[2-(5-methylfuran-2-yl)ethyl]-5-(methylsulfanylmethyl)furan-2-carboxamide
CID 90652745
3-chloro-N-[2-(5-methylfuran-2-yl)ethyl]propanamide
CID 115162657
2-amino-4-[2-(5-methylfuran-2-yl)ethylamino]-4-oxobutanoic acid
CID 115181165
4-amino-N-[2-(5-methylfuran-2-yl)ethyl]cyclohexane-1-carboxamide
CID 115150584
2-[2-(5-methylfuran-2-yl)ethylamino]ethanol
CID 115216331
1-[2-(5-methylfuran-2-yl)ethylamino]propan-2-one
CID 115235079

Frequently Asked Questions

What is the IUPAC name of 1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide (CID 115182418) is 1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide is Cc1ccc(CCNC(=O)C2(CO)CC2)o1.
What is the InChIKey of 1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide?
The InChIKey is PZWKGZRXTHUFAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-9-2-3-10(16-9)4-7-13-11(15)12(8-14)5-6-12/h2-3,14H,4-8H2,1H3,(H,13,15).
What are the key properties of 1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide?
1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide has a molecular weight of 223.27 g/mol, XLogP of 1.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(hydroxymethyl)-N-[2-(5-methylfuran-2-yl)ethyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 115182418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).