N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide

C10H13NO3 — CID 115764587

IUPACN-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide
SMILESCc1ccoc1C(=O)NC1(CO)CC1
InChIInChI=1S/C10H13NO3/c1-7-2-5-14-8(7)9(13)11-10(6-12)3-4-10/h2,5,12H,3-4,6H2,1H3,(H,11,13)
InChIKeyGIWFFJDKWRUVBP-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.84
Rot. Bonds3

About N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide

N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide (PubChem CID 115764587) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide
PubChem CID115764587
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC NameN-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide
SMILESCc1ccoc1C(=O)NC1(CO)CC1
InChIInChI=1S/C10H13NO3/c1-7-2-5-14-8(7)9(13)11-10(6-12)3-4-10/h2,5,12H,3-4,6H2,1H3,(H,11,13)
InChIKeyGIWFFJDKWRUVBP-UHFFFAOYSA-N
XLogP0.84
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(3-methylfuran-2-carbonyl)amino]cyclobutane-1-carboxylic acid
CID 81158869
N-[1-(hydroxymethyl)cyclopropyl]-3,4-dimethylbenzamide
CID 115764896
N-[1-(hydroxymethyl)cyclopentyl]-4-methyl-1,2-oxazole-5-carboxamide
CID 66335560
3-methyl-N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide
CID 24597403
N-(2,2-difluoro-3-hydroxypropyl)-3-methylfuran-2-carboxamide
CID 104858004
2-[(3-methylfuran-2-carbonyl)amino]-3-sulfanylpropanoic acid
CID 16776859
4-bromo-N-[1-(hydroxymethyl)cyclopropyl]-3-methylbenzamide
CID 115877703
N-[1-(hydroxymethyl)cyclopropyl]-5,6-dimethylpyridine-2-carboxamide
CID 168957468
4-tert-butyl-N-[1-(hydroxymethyl)cyclopropyl]benzamide
CID 115764816
N-cyclopropyl-3-methylfuran-2-carboxamide
CID 60675996
N-(cyanomethyl)-3-methylfuran-2-carboxamide
CID 60893946
N-[4-(hydroxymethyl)oxan-4-yl]-4-methyl-1,3-oxazole-5-carboxamide
CID 104630371

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide (CID 115764587) is N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide is Cc1ccoc1C(=O)NC1(CO)CC1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide?
The InChIKey is GIWFFJDKWRUVBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-7-2-5-14-8(7)9(13)11-10(6-12)3-4-10/h2,5,12H,3-4,6H2,1H3,(H,11,13).
What are the key properties of N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide?
N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide has a molecular weight of 195.22 g/mol, XLogP of 0.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclopropyl]-3-methylfuran-2-carboxamide is sourced from PubChem (CID 115764587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).