N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline

C14H19N5 — CID 64920339

IUPACN-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline
SMILESCCC(Nc1ccc(C)c(-n2cnnn2)c1)C1CC1
InChIInChI=1S/C14H19N5/c1-3-13(11-5-6-11)16-12-7-4-10(2)14(8-12)19-9-15-17-18-19/h4,7-9,11,13,16H,3,5-6H2,1-2H3
InChIKeyHSNUHKIWFRFYGH-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.57
Rot. Bonds5

About N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline

N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline (PubChem CID 64920339) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline.

Molecular Properties

Compound NameN-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline
PubChem CID64920339
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC NameN-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline
SMILESCCC(Nc1ccc(C)c(-n2cnnn2)c1)C1CC1
InChIInChI=1S/C14H19N5/c1-3-13(11-5-6-11)16-12-7-4-10(2)14(8-12)19-9-15-17-18-19/h4,7-9,11,13,16H,3,5-6H2,1-2H3
InChIKeyHSNUHKIWFRFYGH-UHFFFAOYSA-N
XLogP2.57
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline 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-(1-cyclopropylpropyl)-3-(tetrazol-1-yl)aniline
CID 64920522
2-[4-methyl-3-(tetrazol-1-yl)anilino]butanoic acid
CID 115352922
4-methyl-N-(2-methylcyclopentyl)-3-(tetrazol-1-yl)aniline
CID 65044046
2-methyl-3-[4-methyl-3-(tetrazol-1-yl)anilino]butan-2-ol
CID 65338038
4-methyl-N-pentyl-3-(tetrazol-1-yl)aniline
CID 43738043
4-methyl-N-[(5-methyloxolan-2-yl)methyl]-3-(tetrazol-1-yl)aniline
CID 82835839
1-N-[4-methyl-3-(tetrazol-1-yl)phenyl]cyclobutane-1,3-diamine
CID 80560812
N-(2,2-dimethoxyethyl)-4-methyl-3-(tetrazol-1-yl)aniline
CID 55231877
2-(cyclopropylmethylamino)-N-[4-methyl-3-(tetrazol-1-yl)phenyl]acetamide;hydrochloride
CID 119720369
ethyl 2-[4-methyl-3-(tetrazol-1-yl)anilino]-2-oxoacetate
CID 50776937
N-(2,5-dimethylcyclohexyl)-4-methyl-3-(tetrazol-1-yl)aniline
CID 64760852
3-chloro-2-methyl-N-[4-methyl-3-(tetrazol-1-yl)phenyl]propanamide
CID 62728665

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline?
The IUPAC name of N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline (CID 64920339) is N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline.
What is the SMILES notation for N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline?
The canonical SMILES for N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline is CCC(Nc1ccc(C)c(-n2cnnn2)c1)C1CC1.
What is the InChIKey of N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline?
The InChIKey is HSNUHKIWFRFYGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-3-13(11-5-6-11)16-12-7-4-10(2)14(8-12)19-9-15-17-18-19/h4,7-9,11,13,16H,3,5-6H2,1-2H3.
What are the key properties of N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline?
N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline has a molecular weight of 257.34 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropyl)-4-methyl-3-(tetrazol-1-yl)aniline is sourced from PubChem (CID 64920339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).