N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine

C14H24N2 — CID 43137393

IUPACN'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine
SMILESCc1ccccc1CN(CCCN)C(C)C
InChIInChI=1S/C14H24N2/c1-12(2)16(10-6-9-15)11-14-8-5-4-7-13(14)3/h4-5,7-8,12H,6,9-11,15H2,1-3H3
InChIKeyHPOUGUYTPFSROP-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.55
Rot. Bonds6

About N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine

N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine (PubChem CID 43137393) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine
PubChem CID43137393
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC NameN'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine
SMILESCc1ccccc1CN(CCCN)C(C)C
InChIInChI=1S/C14H24N2/c1-12(2)16(10-6-9-15)11-14-8-5-4-7-13(14)3/h4-5,7-8,12H,6,9-11,15H2,1-3H3
InChIKeyHPOUGUYTPFSROP-UHFFFAOYSA-N
XLogP2.55
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine 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-[[2-(aminomethyl)phenyl]methyl]-N-propan-2-ylpentan-1-amine
CID 55001809
N'-benzyl-N'-propan-2-ylheptane-1,7-diamine
CID 28597865
N'-ethyl-N'-[(2-methylphenyl)methyl]pentane-1,5-diamine
CID 54965709
N-(3-aminopropyl)-2-methyl-N-propan-2-ylbenzamide
CID 43136684
N'-(4-methoxyphenyl)-N'-[(2-methylphenyl)methyl]propane-1,3-diamine
CID 28770933
N-[[4-(aminomethyl)-2-methylphenyl]methyl]-N-propan-2-ylpentan-1-amine
CID 114478711
2-[[2-hydroxyethyl(propan-2-yl)amino]methyl]-6-methylphenol
CID 115903809
N,N,N',N'-tetrakis[(2-methylphenyl)methyl]ethane-1,2-diamine
CID 86028064
(2S)-1-[(2-methylphenyl)methyl-propan-2-ylamino]-3-propan-2-yloxypropan-2-ol
CID 93164988
1-[[[3-aminopropyl(methyl)sulfamoyl]amino]methyl]-2-methylbenzene
CID 54952251
N'-propan-2-yl-N'-(thiophen-2-ylmethyl)hexane-1,6-diamine
CID 54946840
N'-[(3-methyl-2-pyridinyl)methyl]-N'-propan-2-ylethane-1,2-diamine
CID 112649923

Frequently Asked Questions

What is the IUPAC name of N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine?
The IUPAC name of N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine (CID 43137393) is N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine.
What is the SMILES notation for N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine?
The canonical SMILES for N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine is Cc1ccccc1CN(CCCN)C(C)C.
What is the InChIKey of N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine?
The InChIKey is HPOUGUYTPFSROP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-12(2)16(10-6-9-15)11-14-8-5-4-7-13(14)3/h4-5,7-8,12H,6,9-11,15H2,1-3H3.
What are the key properties of N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine?
N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine has a molecular weight of 220.36 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(2-methylphenyl)methyl]-N'-propan-2-ylpropane-1,3-diamine is sourced from PubChem (CID 43137393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).