1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol

C7H15N5O — CID 107047966

IUPAC1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol
SMILESCN(C)CC(O)Cc1nnn(C)n1
InChIInChI=1S/C7H15N5O/c1-11(2)5-6(13)4-7-8-10-12(3)9-7/h6,13H,4-5H2,1-3H3
InChIKeyWNSXZEBHQFSULV-UHFFFAOYSA-N
MW185.23 g/mol
LogP-1.32
Rot. Bonds4

About 1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol

1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol (PubChem CID 107047966) has the molecular formula C7H15N5O and a molecular weight of 185.23 g/mol. Its IUPAC name is 1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol.

Molecular Properties

Compound Name1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol
PubChem CID107047966
Molecular FormulaC7H15N5O
Molecular Weight185.23 g/mol
Exact Mass185.13
IUPAC Name1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol
SMILESCN(C)CC(O)Cc1nnn(C)n1
InChIInChI=1S/C7H15N5O/c1-11(2)5-6(13)4-7-8-10-12(3)9-7/h6,13H,4-5H2,1-3H3
InChIKeyWNSXZEBHQFSULV-UHFFFAOYSA-N
XLogP-1.32
TPSA67.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-1.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2-methyltetrazol-5-yl)octan-2-ol
CID 107046019
4-methoxy-4-methyl-1-(2-methyltetrazol-5-yl)pentan-2-ol
CID 107046551
1-(2-methylpropylsulfanyl)-3-(2-methyltetrazol-5-yl)propan-2-ol
CID 107047829
1-(2-methyltetrazol-5-yl)-3-(propylamino)propan-2-ol
CID 107057608
1-butan-2-ylsulfanyl-3-(2-methyltetrazol-5-yl)propan-2-ol
CID 107047831
N,N-dimethyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 910865
2-methyl-3-(2-methyltetrazol-5-yl)propan-1-ol
CID 107057756
1-(2-fluorophenyl)-3-(2-methyltetrazol-5-yl)propan-2-ol
CID 107047726
1-(2-methyltetrazol-5-yl)-4-phenylpentan-2-ol
CID 107046002
1-(2-methyltetrazol-5-yl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-ol
CID 107047760
1-(1-methoxycyclobutyl)-3-(2-methyltetrazol-5-yl)propan-2-ol
CID 107065829
3-methoxy-3-methyl-1-(2-methyltetrazol-5-yl)butan-2-ol
CID 107047970

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol?
The IUPAC name of 1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol (CID 107047966) is 1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol.
What is the SMILES notation for 1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol?
The canonical SMILES for 1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol is CN(C)CC(O)Cc1nnn(C)n1.
What is the InChIKey of 1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol?
The InChIKey is WNSXZEBHQFSULV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N5O/c1-11(2)5-6(13)4-7-8-10-12(3)9-7/h6,13H,4-5H2,1-3H3.
What are the key properties of 1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol?
1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol has a molecular weight of 185.23 g/mol, XLogP of -1.32, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)-3-(2-methyltetrazol-5-yl)propan-2-ol is sourced from PubChem (CID 107047966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).