1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol

C8H15N5O — CID 107046313

IUPAC1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol
SMILESCn1nnc(CC(O)(CN)C2CC2)n1
InChIInChI=1S/C8H15N5O/c1-13-11-7(10-12-13)4-8(14,5-9)6-2-3-6/h6,14H,2-5,9H2,1H3
InChIKeyXGDATUKZYJDVJR-UHFFFAOYSA-N
MW197.24 g/mol
LogP-1.15
Rot. Bonds4

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

1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol (PubChem CID 107046313) has the molecular formula C8H15N5O and a molecular weight of 197.24 g/mol. Its IUPAC name is 1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol.

Molecular Properties

Compound Name1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol
PubChem CID107046313
Molecular FormulaC8H15N5O
Molecular Weight197.24 g/mol
Exact Mass197.13
IUPAC Name1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol
SMILESCn1nnc(CC(O)(CN)C2CC2)n1
InChIInChI=1S/C8H15N5O/c1-13-11-7(10-12-13)4-8(14,5-9)6-2-3-6/h6,14H,2-5,9H2,1H3
InChIKeyXGDATUKZYJDVJR-UHFFFAOYSA-N
XLogP-1.15
TPSA89.85 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-1.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-cyclopropyl-2-methyl-3-(2-methyltetrazol-5-yl)propan-1-amine
CID 107053537
1-amino-2-[(2-methyltetrazol-5-yl)methyl]butan-2-ol
CID 107046307
N-tert-butyl-2-cyclopropyl-2-methyl-3-(2-methyltetrazol-5-yl)propan-1-amine
CID 107053545
2-(aminomethyl)-3-methyl-2-[(2-methyltetrazol-5-yl)methyl]butanoic acid
CID 107067051
1-(4-tert-butylcyclohexyl)-2-(2-methyltetrazol-5-yl)ethanol
CID 107046399
N-[2,3-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]butyl]cyclopropanamine
CID 107053558
1-cyclopentyl-2-(2-methyltetrazol-5-yl)ethanone
CID 107046907
3-hydroxy-3-methyl-4-(2-methyltetrazol-5-yl)butanal
CID 107046138
2,2-dimethyl-3-(2-methyltetrazol-5-yl)propanoic acid
CID 107045107
2,3-dimethyl-1-(2-methyltetrazol-5-yl)butan-2-amine
CID 107046659
2-cyclopropyl-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-3-(2-methyltetrazol-5-yl)propanoic acid
CID 107067066
1-cycloheptyl-2-(2-methyltetrazol-5-yl)ethanone
CID 107047149

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol?
The IUPAC name of 1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol (CID 107046313) is 1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol.
What is the SMILES notation for 1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol?
The canonical SMILES for 1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol is Cn1nnc(CC(O)(CN)C2CC2)n1.
What is the InChIKey of 1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol?
The InChIKey is XGDATUKZYJDVJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O/c1-13-11-7(10-12-13)4-8(14,5-9)6-2-3-6/h6,14H,2-5,9H2,1H3.
What are the key properties of 1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol?
1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol has a molecular weight of 197.24 g/mol, XLogP of -1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-ol is sourced from PubChem (CID 107046313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).