1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine

C7H11N7 — CID 63152369

IUPAC1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine
SMILESCc1[nH]ncc1CNc1nnnn1C
InChIInChI=1S/C7H11N7/c1-5-6(4-9-10-5)3-8-7-11-12-13-14(7)2/h4H,3H2,1-2H3,(H,9,10)(H,8,11,13)
InChIKeyRFMLCNIERFZKQX-UHFFFAOYSA-N
MW193.21 g/mol
LogP-0.15
Rot. Bonds3

About 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine

1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine (PubChem CID 63152369) has the molecular formula C7H11N7 and a molecular weight of 193.21 g/mol. Its IUPAC name is 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine.

Molecular Properties

Compound Name1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine
PubChem CID63152369
Molecular FormulaC7H11N7
Molecular Weight193.21 g/mol
Exact Mass193.11
IUPAC Name1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine
SMILESCc1[nH]ncc1CNc1nnnn1C
InChIInChI=1S/C7H11N7/c1-5-6(4-9-10-5)3-8-7-11-12-13-14(7)2/h4H,3H2,1-2H3,(H,9,10)(H,8,11,13)
InChIKeyRFMLCNIERFZKQX-UHFFFAOYSA-N
XLogP-0.15
TPSA84.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine?
The IUPAC name of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine (CID 63152369) is 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine.
What is the SMILES notation for 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine?
The canonical SMILES for 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine is Cc1[nH]ncc1CNc1nnnn1C.
What is the InChIKey of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine?
The InChIKey is RFMLCNIERFZKQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N7/c1-5-6(4-9-10-5)3-8-7-11-12-13-14(7)2/h4H,3H2,1-2H3,(H,9,10)(H,8,11,13).
What are the key properties of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine?
1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine has a molecular weight of 193.21 g/mol, XLogP of -0.15, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine is sourced from PubChem (CID 63152369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).