N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine

C15H24N2 — CID 62544891

IUPACN'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine
SMILESCc1cc(C)c(CN(CCN)C2CC2)c(C)c1
InChIInChI=1S/C15H24N2/c1-11-8-12(2)15(13(3)9-11)10-17(7-6-16)14-4-5-14/h8-9,14H,4-7,10,16H2,1-3H3
InChIKeyZSGFQSPXUNSVEU-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.53
Rot. Bonds5

About N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine

N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine (PubChem CID 62544891) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine
PubChem CID62544891
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine
SMILESCc1cc(C)c(CN(CCN)C2CC2)c(C)c1
InChIInChI=1S/C15H24N2/c1-11-8-12(2)15(13(3)9-11)10-17(7-6-16)14-4-5-14/h8-9,14H,4-7,10,16H2,1-3H3
InChIKeyZSGFQSPXUNSVEU-UHFFFAOYSA-N
XLogP2.53
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[cyclopropyl-[(2,4,6-trimethylphenyl)methyl]amino]propanethioamide
CID 62545066
4-N-ethyl-4-N-[(2,4,6-trimethylphenyl)methyl]cyclohexane-1,4-diamine
CID 79115828
N-propyl-N-[(2,4,6-trimethylphenyl)methyl]azetidin-3-amine
CID 66182423
N'-cyclobutyl-N'-[(3,4-dimethylphenyl)methyl]ethane-1,2-diamine
CID 102875205
N-propyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-3-amine
CID 63637073
N'-methyl-N'-[(2,4,6-trimethylphenyl)methyl]propane-1,3-diamine
CID 62543775
4-[methyl-[(2,4,6-trimethylphenyl)methyl]amino]cyclohexan-1-ol
CID 115149528
(3S)-N-butyl-1,1-dioxo-N-[(2,4,6-trimethylphenyl)methyl]thiolan-3-amine
CID 95173598
N'-cyclohexyl-N'-[(5-methyl-3-pyridinyl)methyl]ethane-1,2-diamine
CID 102879102
N'-[(4-tert-butylphenyl)methyl]-N'-cyclopropylethane-1,2-diamine
CID 39349485
N'-cyclopropyl-N'-[(2,5-dichlorophenyl)methyl]ethane-1,2-diamine
CID 66568165
N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]ethane-1,2-diamine
CID 61350906

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine?
The IUPAC name of N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine (CID 62544891) is N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine?
The canonical SMILES for N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine is Cc1cc(C)c(CN(CCN)C2CC2)c(C)c1.
What is the InChIKey of N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine?
The InChIKey is ZSGFQSPXUNSVEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-11-8-12(2)15(13(3)9-11)10-17(7-6-16)14-4-5-14/h8-9,14H,4-7,10,16H2,1-3H3.
What are the key properties of N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine?
N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine has a molecular weight of 232.37 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N'-[(2,4,6-trimethylphenyl)methyl]ethane-1,2-diamine is sourced from PubChem (CID 62544891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).