N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine

C9H19N5 — CID 107053097

IUPACN-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine
SMILESCCNCC(C)(C)Cc1nnn(C)n1
InChIInChI=1S/C9H19N5/c1-5-10-7-9(2,3)6-8-11-13-14(4)12-8/h10H,5-7H2,1-4H3
InChIKeyLKOBEKRZGLSSGY-UHFFFAOYSA-N
MW197.29 g/mol
LogP0.39
Rot. Bonds5

About N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine

N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine (PubChem CID 107053097) has the molecular formula C9H19N5 and a molecular weight of 197.29 g/mol. Its IUPAC name is N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine
PubChem CID107053097
Molecular FormulaC9H19N5
Molecular Weight197.29 g/mol
Exact Mass197.16
IUPAC NameN-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine
SMILESCCNCC(C)(C)Cc1nnn(C)n1
InChIInChI=1S/C9H19N5/c1-5-10-7-9(2,3)6-8-11-13-14(4)12-8/h10H,5-7H2,1-4H3
InChIKeyLKOBEKRZGLSSGY-UHFFFAOYSA-N
XLogP0.39
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.29
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-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

N-ethyl-3,3-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]butan-1-amine
CID 107053527
5-[3-chloro-2-(chloromethyl)-2-methylpropyl]-2-methyltetrazole
CID 107058457
N-ethyl-2,2-dimethyl-3-(1-methylpyrazol-3-yl)propan-1-amine
CID 82871999
2-ethyl-N-(2-methoxyethyl)-2-[(2-methyltetrazol-5-yl)methyl]butan-1-amine
CID 107053196
N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]ethanamine
CID 107053296
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
N-tert-butyl-2-cyclopropyl-2-methyl-3-(2-methyltetrazol-5-yl)propan-1-amine
CID 107053545
(E)-N-ethyl-5-(2-methyltetrazol-5-yl)pent-3-en-1-amine
CID 107058714
2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine
CID 107049249
2,3,3-trimethyl-N-[(2-methyltetrazol-5-yl)methyl]butan-1-amine
CID 107042638

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine?
The IUPAC name of N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine (CID 107053097) is N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine?
The canonical SMILES for N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine is CCNCC(C)(C)Cc1nnn(C)n1.
What is the InChIKey of N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine?
The InChIKey is LKOBEKRZGLSSGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N5/c1-5-10-7-9(2,3)6-8-11-13-14(4)12-8/h10H,5-7H2,1-4H3.
What are the key properties of N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine?
N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine has a molecular weight of 197.29 g/mol, XLogP of 0.39, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2-dimethyl-3-(2-methyltetrazol-5-yl)propan-1-amine is sourced from PubChem (CID 107053097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).