[2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol

C14H19N5O — CID 106362209

IUPAC[2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol
SMILESOCC1CCCCC1Nc1nnnn1-c1ccccc1
InChIInChI=1S/C14H19N5O/c20-10-11-6-4-5-9-13(11)15-14-16-17-18-19(14)12-7-2-1-3-8-12/h1-3,7-8,11,13,20H,4-6,9-10H2,(H,15,16,18)
InChIKeyJTZABPSNNYSZIT-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.63
Rot. Bonds4

About [2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol

[2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol (PubChem CID 106362209) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is [2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol
PubChem CID106362209
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name[2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol
SMILESOCC1CCCCC1Nc1nnnn1-c1ccccc1
InChIInChI=1S/C14H19N5O/c20-10-11-6-4-5-9-13(11)15-14-16-17-18-19(14)12-7-2-1-3-8-12/h1-3,7-8,11,13,20H,4-6,9-10H2,(H,15,16,18)
InChIKeyJTZABPSNNYSZIT-UHFFFAOYSA-N
XLogP1.63
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(1R,2S)-2-methylcyclohexyl]-1-phenyltetrazol-5-amine
CID 9311708
(2R,3S,4S)-2-(hydroxymethyl)-4-[(1-phenyltetrazol-5-yl)amino]oxan-3-ol
CID 154817090
N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-1-phenyltetrazol-5-amine
CID 11938976
N-[(2-aminocyclohexyl)methyl]-1-phenyltetrazol-5-amine
CID 64927678
[2-[(1-methyltetrazol-5-yl)amino]cyclopentyl]methanol
CID 103703668
1-N-methyl-4-N-(1-phenyltetrazol-5-yl)cyclohexane-1,4-diamine
CID 79110566
2-(hydroxymethyl)-2-[(1-phenyltetrazol-5-yl)amino]propane-1,3-diol
CID 107849570
N-[[(2S)-oxolan-2-yl]methyl]-1-phenyltetrazol-5-amine
CID 8001539
1-benzyl-N-(1-phenyltetrazol-5-yl)piperidin-1-ium-4-amine
CID 2561113
[2-(pyridin-2-ylamino)cyclohexyl]methanol
CID 106362177
N-(1,1-dioxothiolan-3-yl)-1-phenyltetrazol-5-amine
CID 43078771
1-phenyl-2-(1-phenyltetrazol-5-yl)hydrazine
CID 134909651

Frequently Asked Questions

What is the IUPAC name of [2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol?
The IUPAC name of [2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol (CID 106362209) is [2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol?
The canonical SMILES for [2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol is OCC1CCCCC1Nc1nnnn1-c1ccccc1.
What is the InChIKey of [2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol?
The InChIKey is JTZABPSNNYSZIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c20-10-11-6-4-5-9-13(11)15-14-16-17-18-19(14)12-7-2-1-3-8-12/h1-3,7-8,11,13,20H,4-6,9-10H2,(H,15,16,18).
What are the key properties of [2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol?
[2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol has a molecular weight of 273.34 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(1-phenyltetrazol-5-yl)amino]cyclohexyl]methanol is sourced from PubChem (CID 106362209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).