N-[2-(methylamino)propyl]furan-3-carboxamide

C9H14N2O2 — CID 103512728

IUPACN-[2-(methylamino)propyl]furan-3-carboxamide
SMILESCNC(C)CNC(=O)c1ccoc1
InChIInChI=1S/C9H14N2O2/c1-7(10-2)5-11-9(12)8-3-4-13-6-8/h3-4,6-7,10H,5H2,1-2H3,(H,11,12)
InChIKeyCBSHPPNABIAWCW-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.62
Rot. Bonds4

About N-[2-(methylamino)propyl]furan-3-carboxamide

N-[2-(methylamino)propyl]furan-3-carboxamide (PubChem CID 103512728) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is N-[2-(methylamino)propyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[2-(methylamino)propyl]furan-3-carboxamide
PubChem CID103512728
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC NameN-[2-(methylamino)propyl]furan-3-carboxamide
SMILESCNC(C)CNC(=O)c1ccoc1
InChIInChI=1S/C9H14N2O2/c1-7(10-2)5-11-9(12)8-3-4-13-6-8/h3-4,6-7,10H,5H2,1-2H3,(H,11,12)
InChIKeyCBSHPPNABIAWCW-UHFFFAOYSA-N
XLogP0.62
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide
CID 111447081
N-(2-bromo-4-methylpentyl)furan-3-carboxamide
CID 107157639
N-(3-amino-3-hydroxyimino-2-methylpropyl)furan-3-carboxamide
CID 76952612
N-(3-bromobutyl)furan-3-carboxamide
CID 114312390
N-(2-anilino-3-methylbutyl)furan-3-carboxamide
CID 47142406
N-(2-cyclopropyl-2-hydroxyethyl)furan-3-carboxamide
CID 63294562
N-[1-[[(2R)-2-(ethylamino)propyl]amino]-1-oxopropan-2-yl]furan-3-carboxamide;hydrochloride
CID 120653406
3,4-dihydroxy-N-[2-(methylamino)propyl]benzamide
CID 107728277
3-(furan-3-carbonylamino)-2-phenylpropanoic acid
CID 62883834
N-(2-chloro-2-cyclopropylethyl)furan-3-carboxamide
CID 114305001
4-N,4-N-diethyl-1-N-[2-(methylamino)propyl]benzene-1,4-dicarboxamide
CID 120828485
4-N-(2,2-dimethylpropyl)-1-N-[2-(methylamino)propyl]benzene-1,4-dicarboxamide;hydrochloride
CID 120830958

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)propyl]furan-3-carboxamide?
The IUPAC name of N-[2-(methylamino)propyl]furan-3-carboxamide (CID 103512728) is N-[2-(methylamino)propyl]furan-3-carboxamide.
What is the SMILES notation for N-[2-(methylamino)propyl]furan-3-carboxamide?
The canonical SMILES for N-[2-(methylamino)propyl]furan-3-carboxamide is CNC(C)CNC(=O)c1ccoc1.
What is the InChIKey of N-[2-(methylamino)propyl]furan-3-carboxamide?
The InChIKey is CBSHPPNABIAWCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-7(10-2)5-11-9(12)8-3-4-13-6-8/h3-4,6-7,10H,5H2,1-2H3,(H,11,12).
What are the key properties of N-[2-(methylamino)propyl]furan-3-carboxamide?
N-[2-(methylamino)propyl]furan-3-carboxamide has a molecular weight of 182.22 g/mol, XLogP of 0.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)propyl]furan-3-carboxamide is sourced from PubChem (CID 103512728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).