N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide

C14H16N2O2 — CID 42759774

IUPACN-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide
SMILESCn1cccc1CN(C(=O)c1ccco1)C1CC1
InChIInChI=1S/C14H16N2O2/c1-15-8-2-4-12(15)10-16(11-6-7-11)14(17)13-5-3-9-18-13/h2-5,8-9,11H,6-7,10H2,1H3
InChIKeyUGFHDUADIGWDMK-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.42
Rot. Bonds4

About N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide

N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide (PubChem CID 42759774) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide
PubChem CID42759774
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide
SMILESCn1cccc1CN(C(=O)c1ccco1)C1CC1
InChIInChI=1S/C14H16N2O2/c1-15-8-2-4-12(15)10-16(11-6-7-11)14(17)13-5-3-9-18-13/h2-5,8-9,11H,6-7,10H2,1H3
InChIKeyUGFHDUADIGWDMK-UHFFFAOYSA-N
XLogP2.42
TPSA38.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclopropylfuran-2-carboxamide
CID 3414991
N-cyclopropyl-N-[2-[furan-2-ylmethyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]propanamide
CID 3892976
N-cyclopropyl-2-methoxy-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 42759797
3-chloro-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 810006
N-cyclopropyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]cyclopropanecarboxamide
CID 811191
2,4-dichloro-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 42759766
2-[cyclopropyl-(2-phenylmethoxyacetyl)amino]-N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]acetamide
CID 4003243
ethyl 2-[cyclopropyl(furan-2-carbonyl)amino]acetate
CID 54983870
N-cyclopropyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-4-ethylbenzamide
CID 1200621
2-chloro-N-cyclopropyl-6-fluoro-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 90495850
N-cyclopropyl-N-(3-methylbutyl)furan-2-carboxamide
CID 60732998
4-tert-butyl-N-cyclopropyl-N-[2-[furan-2-ylmethyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]benzamide
CID 1057184

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide?
The IUPAC name of N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide (CID 42759774) is N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide?
The canonical SMILES for N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide is Cn1cccc1CN(C(=O)c1ccco1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide?
The InChIKey is UGFHDUADIGWDMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-15-8-2-4-12(15)10-16(11-6-7-11)14(17)13-5-3-9-18-13/h2-5,8-9,11H,6-7,10H2,1H3.
What are the key properties of N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide?
N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide has a molecular weight of 244.29 g/mol, XLogP of 2.42, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]furan-2-carboxamide is sourced from PubChem (CID 42759774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).