N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine

C8H13N7 — CID 107045468

IUPACN-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine
SMILESCNCc1nccn1Cc1nnn(C)n1
InChIInChI=1S/C8H13N7/c1-9-5-8-10-3-4-15(8)6-7-11-13-14(2)12-7/h3-4,9H,5-6H2,1-2H3
InChIKeyJMSWZRGKEWCQEW-UHFFFAOYSA-N
MW207.24 g/mol
LogP-0.83
Rot. Bonds4

About N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine

N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine (PubChem CID 107045468) has the molecular formula C8H13N7 and a molecular weight of 207.24 g/mol. Its IUPAC name is N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine
PubChem CID107045468
Molecular FormulaC8H13N7
Molecular Weight207.24 g/mol
Exact Mass207.12
IUPAC NameN-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine
SMILESCNCc1nccn1Cc1nnn(C)n1
InChIInChI=1S/C8H13N7/c1-9-5-8-10-3-4-15(8)6-7-11-13-14(2)12-7/h3-4,9H,5-6H2,1-2H3
InChIKeyJMSWZRGKEWCQEW-UHFFFAOYSA-N
XLogP-0.83
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.24
LogP ≤ 5-0.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]ethanamine
CID 107052795
N-methyl-1-[1-[(1-methyltriazol-4-yl)methyl]imidazol-2-yl]methanamine
CID 107045469
1-[2-[2-(methylaminomethyl)imidazol-1-yl]ethyl]pyridin-2-one
CID 82907641
1-[1-[(3,4-dichlorophenyl)methyl]imidazol-2-yl]-N-methylmethanamine
CID 42656322
3-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]aniline
CID 107042816
1-[1-[(1-butan-2-ylpyrazol-3-yl)methyl]imidazol-2-yl]-N-methylmethanamine
CID 64784053
N-methyl-3-[2-(methylaminomethyl)imidazol-1-yl]propanamide
CID 62325583
N-methyl-1-[1-(2-propan-2-ylsulfonylethyl)imidazol-2-yl]methanamine
CID 106717648
3-[(2-methyltetrazol-5-yl)methyl]-1,3-thiazol-2-one
CID 107054418
N-methyl-1-[1-[[4-(trifluoromethoxy)phenyl]methyl]imidazol-2-yl]methanamine
CID 62221603
1-[(2-methyltetrazol-5-yl)methyl]indole-4-carbonitrile
CID 107919149
N-methyl-1-[1-[(2-nitrophenyl)methyl]imidazol-2-yl]methanamine
CID 55048706

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine?
The IUPAC name of N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine (CID 107045468) is N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine is CNCc1nccn1Cc1nnn(C)n1.
What is the InChIKey of N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine?
The InChIKey is JMSWZRGKEWCQEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N7/c1-9-5-8-10-3-4-15(8)6-7-11-13-14(2)12-7/h3-4,9H,5-6H2,1-2H3.
What are the key properties of N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine?
N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine has a molecular weight of 207.24 g/mol, XLogP of -0.83, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-[(2-methyltetrazol-5-yl)methyl]imidazol-2-yl]methanamine is sourced from PubChem (CID 107045468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).