N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine

C14H14N6 — CID 79251622

IUPACN-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine
SMILESCNc1ccnc(Cn2nnc(-c3ccccc3)n2)c1
InChIInChI=1S/C14H14N6/c1-15-12-7-8-16-13(9-12)10-20-18-14(17-19-20)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,15,16)
InChIKeyIMFDHNZZDPAMPE-UHFFFAOYSA-N
MW266.31 g/mol
LogP1.83
Rot. Bonds4

About N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine

N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine (PubChem CID 79251622) has the molecular formula C14H14N6 and a molecular weight of 266.31 g/mol. Its IUPAC name is N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine.

Molecular Properties

Compound NameN-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine
PubChem CID79251622
Molecular FormulaC14H14N6
Molecular Weight266.31 g/mol
Exact Mass266.13
IUPAC NameN-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine
SMILESCNc1ccnc(Cn2nnc(-c3ccccc3)n2)c1
InChIInChI=1S/C14H14N6/c1-15-12-7-8-16-13(9-12)10-20-18-14(17-19-20)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,15,16)
InChIKeyIMFDHNZZDPAMPE-UHFFFAOYSA-N
XLogP1.83
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(5-phenyltetrazol-2-yl)methyl]pyridine
CID 134010962
[4-[(5-phenyltetrazol-2-yl)methyl]-2-pyridinyl]hydrazine
CID 62471223
2-chloro-5-[(5-phenyltetrazol-2-yl)methyl]pyrazine
CID 103054482
N-methyl-2-[(4-methylpiperazin-1-yl)methyl]pyridin-4-amine
CID 79245636
methyl 6-[(5-phenyltetrazol-2-yl)methyl]pyridine-3-carboxylate
CID 162443610
N-methyl-1-[5-[(5-phenyltetrazol-2-yl)methyl]furan-3-yl]methanamine
CID 62446607
N-methyl-1-[5-methyl-4-[(5-phenyltetrazol-2-yl)methyl]furan-2-yl]methanamine
CID 62447912
methyl 2-[(5-phenyltetrazol-2-yl)methyl]furan-3-carboxylate
CID 134024131
N-[2-(5-phenyltetrazol-2-yl)ethyl]propan-2-amine
CID 55070699
N-methyl-2-[(2-methylimidazol-1-yl)methyl]pyridin-4-amine
CID 79251372
[3-methyl-5-[(5-phenyltetrazol-2-yl)methyl]furan-2-yl]methanamine
CID 62449218
[3-[(5-phenyltetrazol-2-yl)methyl]furan-2-yl]methanamine
CID 62448659

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine?
The IUPAC name of N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine (CID 79251622) is N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine.
What is the SMILES notation for N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine?
The canonical SMILES for N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine is CNc1ccnc(Cn2nnc(-c3ccccc3)n2)c1.
What is the InChIKey of N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine?
The InChIKey is IMFDHNZZDPAMPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6/c1-15-12-7-8-16-13(9-12)10-20-18-14(17-19-20)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,15,16).
What are the key properties of N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine?
N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine has a molecular weight of 266.31 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(5-phenyltetrazol-2-yl)methyl]pyridin-4-amine is sourced from PubChem (CID 79251622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).