N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine

C14H23N — CID 60818877

IUPACN-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine
SMILESCCNC(Cc1ccccc1C)C(C)C
InChIInChI=1S/C14H23N/c1-5-15-14(11(2)3)10-13-9-7-6-8-12(13)4/h6-9,11,14-15H,5,10H2,1-4H3
InChIKeyWVPBTHGAAJZPIT-UHFFFAOYSA-N
MW205.35 g/mol
LogP3.17
Rot. Bonds5

About N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine

N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine (PubChem CID 60818877) has the molecular formula C14H23N and a molecular weight of 205.35 g/mol. Its IUPAC name is N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine.

Molecular Properties

Compound NameN-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine
PubChem CID60818877
Molecular FormulaC14H23N
Molecular Weight205.35 g/mol
Exact Mass205.18
IUPAC NameN-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine
SMILESCCNC(Cc1ccccc1C)C(C)C
InChIInChI=1S/C14H23N/c1-5-15-14(11(2)3)10-13-9-7-6-8-12(13)4/h6-9,11,14-15H,5,10H2,1-4H3
InChIKeyWVPBTHGAAJZPIT-UHFFFAOYSA-N
XLogP3.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.35
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-1-(2-methylphenyl)propan-2-amine
CID 14025646
N-ethyl-1-(2-methylphenyl)-3-methylsulfonylbutan-2-amine
CID 113422155
N-ethyl-4,5,5-trimethyl-1-(2-methylphenyl)hexan-2-amine
CID 63833817
3-ethoxy-N,4-dimethyl-1-(2-methylphenyl)pentan-2-amine
CID 116721266
3-ethyl-1-(2-methylphenyl)-N-propylpentan-2-amine
CID 63528106
N-ethyl-2-(2-methylphenyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
CID 66475769
3-methyl-2-[(2-methylphenyl)methyl]-N-propan-2-ylbutan-1-amine
CID 62529551
N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine
CID 61065597
methane;1-methyl-2-(2-methylpropyl)benzene
CID 142148493
N-ethyl-2-(2-methylphenyl)-1-thiophen-2-ylethanamine
CID 43490566
N-ethyl-1-(2-iodophenyl)-2-(2-methylphenyl)ethanamine
CID 63528971
1-(5-fluoro-2-methylphenyl)-3-methyl-N-propylbutan-2-amine
CID 105373704

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine?
The IUPAC name of N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine (CID 60818877) is N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine.
What is the SMILES notation for N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine?
The canonical SMILES for N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine is CCNC(Cc1ccccc1C)C(C)C.
What is the InChIKey of N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine?
The InChIKey is WVPBTHGAAJZPIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-5-15-14(11(2)3)10-13-9-7-6-8-12(13)4/h6-9,11,14-15H,5,10H2,1-4H3.
What are the key properties of N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine?
N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine has a molecular weight of 205.35 g/mol, XLogP of 3.17, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-1-(2-methylphenyl)butan-2-amine is sourced from PubChem (CID 60818877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).