N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide

C16H17N5O2 — CID 131898891

IUPACN-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide
SMILESCc1nnnn1CCC(=O)NC(c1ccccc1)c1ccco1
InChIInChI=1S/C16H17N5O2/c1-12-18-19-20-21(12)10-9-15(22)17-16(14-8-5-11-23-14)13-6-3-2-4-7-13/h2-8,11,16H,9-10H2,1H3,(H,17,22)
InChIKeyHBBGJEVTVFVKEA-UHFFFAOYSA-N
MW311.35 g/mol
LogP1.87
Rot. Bonds6

About N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide

N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide (PubChem CID 131898891) has the molecular formula C16H17N5O2 and a molecular weight of 311.35 g/mol. Its IUPAC name is N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide
PubChem CID131898891
Molecular FormulaC16H17N5O2
Molecular Weight311.35 g/mol
Exact Mass311.14
IUPAC NameN-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide
SMILESCc1nnnn1CCC(=O)NC(c1ccccc1)c1ccco1
InChIInChI=1S/C16H17N5O2/c1-12-18-19-20-21(12)10-9-15(22)17-16(14-8-5-11-23-14)13-6-3-2-4-7-13/h2-8,11,16H,9-10H2,1H3,(H,17,22)
InChIKeyHBBGJEVTVFVKEA-UHFFFAOYSA-N
XLogP1.87
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.35
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide 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-[furan-2-yl(phenyl)methyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide
CID 131931060
N-[2-(methylamino)-2-oxo-1-phenylethyl]-3-(5-methyltetrazol-1-yl)propanamide
CID 91795241
3-chloro-N-[furan-2-yl(phenyl)methyl]propanamide
CID 60780331
3-(5-methyltetrazol-1-yl)-N-(2-methyl-1-thiophen-2-ylpropyl)propanamide
CID 46960745
N-[(4-chlorophenyl)-pyridin-4-ylmethyl]-3-(5-methyltetrazol-1-yl)propanamide
CID 91765018
5-[[furan-2-yl(phenyl)methyl]amino]-5-oxopentanoic acid
CID 60708135
N-[furan-2-yl(phenyl)methyl]-2-(propylamino)acetamide
CID 60661858
5-chloro-N-[furan-2-yl(phenyl)methyl]pentanamide
CID 60780335
N-[(1R)-3-methyl-1-pyridin-3-ylbutyl]-3-(5-methyltetrazol-1-yl)propanamide
CID 125168942
N-[furan-2-yl(phenyl)methyl]-2-methoxyacetamide
CID 47140612
3-[(3aR,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[(R)-furan-2-yl(phenyl)methyl]propanamide
CID 8928284
3-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[(S)-furan-2-yl(phenyl)methyl]propanamide
CID 11934924

Frequently Asked Questions

What is the IUPAC name of N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide?
The IUPAC name of N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide (CID 131898891) is N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide.
What is the SMILES notation for N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide?
The canonical SMILES for N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide is Cc1nnnn1CCC(=O)NC(c1ccccc1)c1ccco1.
What is the InChIKey of N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide?
The InChIKey is HBBGJEVTVFVKEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O2/c1-12-18-19-20-21(12)10-9-15(22)17-16(14-8-5-11-23-14)13-6-3-2-4-7-13/h2-8,11,16H,9-10H2,1H3,(H,17,22).
What are the key properties of N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide?
N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide has a molecular weight of 311.35 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[furan-2-yl(phenyl)methyl]-3-(5-methyltetrazol-1-yl)propanamide is sourced from PubChem (CID 131898891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).