N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine

C19H23N5O2 — CID 77094972

IUPACN-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine
SMILESCN(Cc1cccc(-c2nn[nH]n2)c1)Cc1ccc(C2CCCCO2)o1
InChIInChI=1S/C19H23N5O2/c1-24(12-14-5-4-6-15(11-14)19-20-22-23-21-19)13-16-8-9-18(26-16)17-7-2-3-10-25-17/h4-6,8-9,11,17H,2-3,7,10,12-13H2,1H3,(H,20,21,22,23)
InChIKeyFMJTVEYGNFRMQB-UHFFFAOYSA-N
MW353.43 g/mol
LogP3.33
Rot. Bonds6

About N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine

N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine (PubChem CID 77094972) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine.

Molecular Properties

Compound NameN-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine
PubChem CID77094972
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC NameN-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine
SMILESCN(Cc1cccc(-c2nn[nH]n2)c1)Cc1ccc(C2CCCCO2)o1
InChIInChI=1S/C19H23N5O2/c1-24(12-14-5-4-6-15(11-14)19-20-22-23-21-19)13-16-8-9-18(26-16)17-7-2-3-10-25-17/h4-6,8-9,11,17H,2-3,7,10,12-13H2,1H3,(H,20,21,22,23)
InChIKeyFMJTVEYGNFRMQB-UHFFFAOYSA-N
XLogP3.33
TPSA80.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine with MolForge

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Related Compounds

N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-thiophen-3-ylmethanamine
CID 56711474
2-[methyl-[[3-(2H-tetrazol-5-yl)phenyl]methyl]amino]-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 124758787
N-methyl-1-[5-(oxan-2-yl)furan-2-yl]-N-(quinoxalin-2-ylmethyl)methanamine
CID 74240539
N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-N-methyl-1-[5-(oxan-2-yl)furan-2-yl]methanamine
CID 131948636
1-[(5S)-3-ethyl-4,5-dihydro-1,2-oxazol-5-yl]-N-methyl-N-[[3-(2H-tetrazol-5-yl)phenyl]methyl]methanamine
CID 124731620
(3S)-N-methyl-3-methylsulfanyl-N-[[3-(2H-tetrazol-5-yl)phenyl]methyl]butan-1-amine
CID 99939871
2-amino-4-(oxan-2-yl)-6-[[3-(2H-tetrazol-5-yl)phenyl]methylsulfanyl]pyridine-3,5-dicarbonitrile
CID 68699258
N-(1,3-benzodioxol-5-ylmethyl)-N-[[5-(oxan-2-yl)furan-2-yl]methyl]cyclopropanamine
CID 131945851
N-methyl-2-oxo-N-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide
CID 90649019
N-[3-(2H-tetrazol-5-yl)phenyl]cyclooctanamine
CID 43732033
3-[[methyl(oxan-2-ylmethyl)amino]methyl]benzenecarbothioamide
CID 61431933
N-methyl-1-[(2R)-oxan-2-yl]-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]methanamine
CID 99613583

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine?
The IUPAC name of N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine (CID 77094972) is N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine.
What is the SMILES notation for N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine?
The canonical SMILES for N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine is CN(Cc1cccc(-c2nn[nH]n2)c1)Cc1ccc(C2CCCCO2)o1.
What is the InChIKey of N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine?
The InChIKey is FMJTVEYGNFRMQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-24(12-14-5-4-6-15(11-14)19-20-22-23-21-19)13-16-8-9-18(26-16)17-7-2-3-10-25-17/h4-6,8-9,11,17H,2-3,7,10,12-13H2,1H3,(H,20,21,22,23).
What are the key properties of N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine?
N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine has a molecular weight of 353.43 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[5-(oxan-2-yl)furan-2-yl]methyl]-1-[3-(2H-tetrazol-5-yl)phenyl]methanamine is sourced from PubChem (CID 77094972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).