N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine

C9H19N5 — CID 107054892

IUPACN-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine
SMILESCCC(CCCc1nnn(C)n1)NC
InChIInChI=1S/C9H19N5/c1-4-8(10-2)6-5-7-9-11-13-14(3)12-9/h8,10H,4-7H2,1-3H3
InChIKeyFNYDWCPQYJMORP-UHFFFAOYSA-N
MW197.29 g/mol
LogP0.53
Rot. Bonds6

About N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine

N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine (PubChem CID 107054892) has the molecular formula C9H19N5 and a molecular weight of 197.29 g/mol. Its IUPAC name is N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine.

Molecular Properties

Compound NameN-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine
PubChem CID107054892
Molecular FormulaC9H19N5
Molecular Weight197.29 g/mol
Exact Mass197.16
IUPAC NameN-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine
SMILESCCC(CCCc1nnn(C)n1)NC
InChIInChI=1S/C9H19N5/c1-4-8(10-2)6-5-7-9-11-13-14(3)12-9/h8,10H,4-7H2,1-3H3
InChIKeyFNYDWCPQYJMORP-UHFFFAOYSA-N
XLogP0.53
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.29
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2-methyltetrazol-5-yl)hexan-3-amine
CID 107054841
5-(4-chloropentyl)-2-methyltetrazole
CID 107055052
5-butyl-2-methyltetrazole;ethane
CID 144800630
N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine
CID 107167915
N,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-3-amine
CID 107044605
1-N,1-N-diethyl-3-N-methyl-4-(2-methyltetrazol-5-yl)butane-1,3-diamine
CID 107050035
N,2-dimethyl-4-(2-methyltetrazol-5-yl)butan-1-amine
CID 107054920
5-(4-bromobutyl)-2-methyltetrazole
CID 107055081
N-[(2-methyltetrazol-5-yl)methyl]hex-5-yn-3-amine
CID 107042699
2-ethyl-N-[(2-methyltetrazol-5-yl)methyl]butan-1-amine
CID 107042740
1-(5-bromo-3-methyltriazol-4-yl)-N-methylpentan-3-amine
CID 106463502
[5-methoxy-1-(2-methyltetrazol-5-yl)pentan-2-yl]hydrazine
CID 107066112

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine?
The IUPAC name of N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine (CID 107054892) is N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine.
What is the SMILES notation for N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine?
The canonical SMILES for N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine is CCC(CCCc1nnn(C)n1)NC.
What is the InChIKey of N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine?
The InChIKey is FNYDWCPQYJMORP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N5/c1-4-8(10-2)6-5-7-9-11-13-14(3)12-9/h8,10H,4-7H2,1-3H3.
What are the key properties of N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine?
N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine has a molecular weight of 197.29 g/mol, XLogP of 0.53, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine is sourced from PubChem (CID 107054892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).