1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine

C15H25N5 — CID 107064859

IUPAC1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine
SMILESCn1nnc(CC(N)CC23CC4CC(CC(C4)C2)C3)n1
InChIInChI=1S/C15H25N5/c1-20-18-14(17-19-20)5-13(16)9-15-6-10-2-11(7-15)4-12(3-10)8-15/h10-13H,2-9,16H2,1H3
InChIKeyHQEFGRKFLRBQTK-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.69
Rot. Bonds4

About 1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine

1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine (PubChem CID 107064859) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is 1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine.

Molecular Properties

Compound Name1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine
PubChem CID107064859
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine
SMILESCn1nnc(CC(N)CC23CC4CC(CC(C4)C2)C3)n1
InChIInChI=1S/C15H25N5/c1-20-18-14(17-19-20)5-13(16)9-15-6-10-2-11(7-15)4-12(3-10)8-15/h10-13H,2-9,16H2,1H3
InChIKeyHQEFGRKFLRBQTK-UHFFFAOYSA-N
XLogP1.69
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107050394
[1-(3-methyl-1-adamantyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066824
1-(1-adamantyl)pentan-2-amine;hydrochloride
CID 12619351
2-(1-adamantyl)-N-(2-methyltetrazol-5-yl)acetamide
CID 5125853
2-(2-methyltetrazol-5-yl)-1-(7-oxabicyclo[2.2.1]heptan-2-yl)ethanamine
CID 107049273
1-(2-methyloxolan-2-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107050310
2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine
CID 107049445
[3-[(2-methyltetrazol-5-yl)methyl]-3-bicyclo[3.1.0]hexanyl]methanamine
CID 107053508
1,1-diethoxy-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107050132
N-methyl-2-(2-methyltetrazol-5-yl)-1-(2-methylthiolan-2-yl)ethanamine
CID 107065238
1-(4-methylphenyl)sulfanyl-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107049663
1-(1-methoxycyclobutyl)-3-(2-methyltetrazol-5-yl)propan-2-ol
CID 107065829

Frequently Asked Questions

What is the IUPAC name of 1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine?
The IUPAC name of 1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine (CID 107064859) is 1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine.
What is the SMILES notation for 1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine?
The canonical SMILES for 1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine is Cn1nnc(CC(N)CC23CC4CC(CC(C4)C2)C3)n1.
What is the InChIKey of 1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine?
The InChIKey is HQEFGRKFLRBQTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-20-18-14(17-19-20)5-13(16)9-15-6-10-2-11(7-15)4-12(3-10)8-15/h10-13H,2-9,16H2,1H3.
What are the key properties of 1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine?
1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine has a molecular weight of 275.40 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine is sourced from PubChem (CID 107064859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).