N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine

C14H15N5 — CID 107042355

IUPACN-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine
SMILESCn1nnc(CNCc2cccc3ccccc23)n1
InChIInChI=1S/C14H15N5/c1-19-17-14(16-18-19)10-15-9-12-7-4-6-11-5-2-3-8-13(11)12/h2-8,15H,9-10H2,1H3
InChIKeyUDKPUPODLXRWMD-UHFFFAOYSA-N
MW253.31 g/mol
LogP1.65
Rot. Bonds4

About N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine

N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine (PubChem CID 107042355) has the molecular formula C14H15N5 and a molecular weight of 253.31 g/mol. Its IUPAC name is N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine.

Molecular Properties

Compound NameN-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine
PubChem CID107042355
Molecular FormulaC14H15N5
Molecular Weight253.31 g/mol
Exact Mass253.13
IUPAC NameN-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine
SMILESCn1nnc(CNCc2cccc3ccccc23)n1
InChIInChI=1S/C14H15N5/c1-19-17-14(16-18-19)10-15-9-12-7-4-6-11-5-2-3-8-13(11)12/h2-8,15H,9-10H2,1H3
InChIKeyUDKPUPODLXRWMD-UHFFFAOYSA-N
XLogP1.65
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methyl-1,2,4-triazol-3-yl)-N-(naphthalen-1-ylmethyl)ethanamine
CID 63328798
N-[[3-methyl-2-[(2-methyltetrazol-5-yl)methoxy]phenyl]methyl]ethanamine
CID 107041605
2-(2-fluorophenyl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine
CID 107042037
2-(2-methyltetrazol-5-yl)-1-naphthalen-1-ylethanone
CID 107046984
2-methoxy-N-[[3-methyl-2-[(2-methyltetrazol-5-yl)methoxy]phenyl]methyl]ethanamine
CID 107041629
N-[[3-fluoro-2-[(2-methyltetrazol-5-yl)methoxy]phenyl]methyl]-2-methoxyethanamine
CID 107041645
N-[[2-[(2-methyltetrazol-5-yl)methoxy]phenyl]methyl]propan-1-amine
CID 107041124
1-(2,5-difluorophenyl)-N-[(2-methyltetrazol-5-yl)methyl]methanamine
CID 107042414
N-(naphthalen-1-ylmethyl)ethanamine;hydrochloride
CID 17290740
N,N'-bis[2-(naphthalen-1-ylmethylamino)ethyl]ethane-1,2-diamine
CID 11766966
2-[(2-methyltetrazol-5-yl)methoxy]naphthalene-1-carbaldehyde
CID 107043143
2-chloro-N-[(2-methyltetrazol-5-yl)methyl]-2-phenylethanamine
CID 107054007

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine?
The IUPAC name of N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine (CID 107042355) is N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine.
What is the SMILES notation for N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine?
The canonical SMILES for N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine is Cn1nnc(CNCc2cccc3ccccc23)n1.
What is the InChIKey of N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine?
The InChIKey is UDKPUPODLXRWMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5/c1-19-17-14(16-18-19)10-15-9-12-7-4-6-11-5-2-3-8-13(11)12/h2-8,15H,9-10H2,1H3.
What are the key properties of N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine?
N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine has a molecular weight of 253.31 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyltetrazol-5-yl)methyl]-1-naphthalen-1-ylmethanamine is sourced from PubChem (CID 107042355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).