3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol

C14H24N2O — CID 64792128

IUPAC3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol
SMILESCCNC(C)(CO)CN(C)c1cccc(C)c1
InChIInChI=1S/C14H24N2O/c1-5-15-14(3,11-17)10-16(4)13-8-6-7-12(2)9-13/h6-9,15,17H,5,10-11H2,1-4H3
InChIKeyIDJYHMZMWORTSV-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.79
Rot. Bonds6

About 3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol

3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol (PubChem CID 64792128) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol.

Molecular Properties

Compound Name3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol
PubChem CID64792128
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol
SMILESCCNC(C)(CO)CN(C)c1cccc(C)c1
InChIInChI=1S/C14H24N2O/c1-5-15-14(3,11-17)10-16(4)13-8-6-7-12(2)9-13/h6-9,15,17H,5,10-11H2,1-4H3
InChIKeyIDJYHMZMWORTSV-UHFFFAOYSA-N
XLogP1.79
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-3-(N,3-dimethylanilino)-2-(ethylamino)propan-1-ol
CID 64791529
2-(cyclopropylamino)-3-(N-ethyl-3-methylanilino)-2-methylpropan-1-ol
CID 64826466
N,N',2,2-tetramethyl-N-(3-methylphenyl)propane-1,3-diamine
CID 62258877
3-(N-ethyl-3-methylanilino)-2,2-dimethylpropan-1-ol
CID 62272248
3-(N,3-dimethylanilino)-2-(ethylamino)propan-1-ol
CID 64789932
4-(N-ethyl-3-methylanilino)-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 64825867
N-cyclopropyl-N',2,2-trimethyl-N'-(3-methylphenyl)propane-1,3-diamine
CID 62259045
N,N'-dimethyl-N'-(3-methylphenyl)methanediamine
CID 115226747
2-N-ethyl-1-N-(3-methoxyphenyl)-1-N,2-dimethylpropane-1,2-diamine
CID 62836361
2-ethyl-2-(ethylamino)-5-(N-ethyl-3-methylanilino)pentan-1-ol
CID 106809347
6-(N,3-dimethylanilino)hexan-1-ol
CID 103737894
1-(N-ethyl-3-methylanilino)-2-methylpropan-2-ol
CID 61101851

Frequently Asked Questions

What is the IUPAC name of 3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol?
The IUPAC name of 3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol (CID 64792128) is 3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol.
What is the SMILES notation for 3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol?
The canonical SMILES for 3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol is CCNC(C)(CO)CN(C)c1cccc(C)c1.
What is the InChIKey of 3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol?
The InChIKey is IDJYHMZMWORTSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-5-15-14(3,11-17)10-16(4)13-8-6-7-12(2)9-13/h6-9,15,17H,5,10-11H2,1-4H3.
What are the key properties of 3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol?
3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol has a molecular weight of 236.36 g/mol, XLogP of 1.79, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(N,3-dimethylanilino)-2-(ethylamino)-2-methylpropan-1-ol is sourced from PubChem (CID 64792128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).