2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline

C14H24N2O — CID 81052636

IUPAC2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline
SMILESCc1ccc(CN)c(N(C)CCOC(C)C)c1
InChIInChI=1S/C14H24N2O/c1-11(2)17-8-7-16(4)14-9-12(3)5-6-13(14)10-15/h5-6,9,11H,7-8,10,15H2,1-4H3
InChIKeyWCJQVUPPVHHEMS-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.31
Rot. Bonds6

About 2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline

2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline (PubChem CID 81052636) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline.

Molecular Properties

Compound Name2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline
PubChem CID81052636
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline
SMILESCc1ccc(CN)c(N(C)CCOC(C)C)c1
InChIInChI=1S/C14H24N2O/c1-11(2)17-8-7-16(4)14-9-12(3)5-6-13(14)10-15/h5-6,9,11H,7-8,10,15H2,1-4H3
InChIKeyWCJQVUPPVHHEMS-UHFFFAOYSA-N
XLogP2.31
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)-3-(trifluoromethyl)aniline
CID 81053579
4-(aminomethyl)-2-chloro-N-methyl-N-(2-propan-2-yloxyethyl)aniline
CID 81052956
2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline
CID 62308997
[5-methyl-2-(2-propan-2-yloxyethoxy)phenyl]methanamine
CID 63322374
N'-[2-(aminomethyl)-5-methylphenyl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 55057011
5-bromo-2-[(cyclopropylamino)methyl]-N-methyl-N-(2-propan-2-yloxyethyl)aniline
CID 81057223
2-bromo-1-N-methyl-1-N-(2-propan-2-yloxyethyl)benzene-1,4-diamine
CID 81059262
4-fluoro-2-N-methyl-2-N-(2-propan-2-yloxyethyl)benzene-1,2-diamine
CID 81058264
N-methyl-2-(methylaminomethyl)-N-(2-propan-2-yloxyethyl)aniline
CID 81057315
2-(1-aminoethyl)-N-methyl-N-(2-propan-2-yloxyethyl)aniline
CID 81055890
2-chloro-4-N,5-dimethyl-4-N-(2-propan-2-yloxyethyl)benzene-1,4-diamine
CID 113334402
2-(aminomethyl)-N,5-dimethyl-N-[(2-methylfuran-3-yl)methyl]aniline
CID 62307943

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline?
The IUPAC name of 2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline (CID 81052636) is 2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline.
What is the SMILES notation for 2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline?
The canonical SMILES for 2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline is Cc1ccc(CN)c(N(C)CCOC(C)C)c1.
What is the InChIKey of 2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline?
The InChIKey is WCJQVUPPVHHEMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-11(2)17-8-7-16(4)14-9-12(3)5-6-13(14)10-15/h5-6,9,11H,7-8,10,15H2,1-4H3.
What are the key properties of 2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline?
2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline has a molecular weight of 236.36 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline is sourced from PubChem (CID 81052636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).