1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol

C14H24N2O — CID 110929931

IUPAC1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol
SMILESCCN(C)CC(O)CN(C)Cc1ccccc1
InChIInChI=1S/C14H24N2O/c1-4-15(2)11-14(17)12-16(3)10-13-8-6-5-7-9-13/h5-9,14,17H,4,10-12H2,1-3H3
InChIKeyDPQWAHYYAKLJER-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.43
Rot. Bonds7

About 1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol

1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol (PubChem CID 110929931) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol
PubChem CID110929931
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol
SMILESCCN(C)CC(O)CN(C)Cc1ccccc1
InChIInChI=1S/C14H24N2O/c1-4-15(2)11-14(17)12-16(3)10-13-8-6-5-7-9-13/h5-9,14,17H,4,10-12H2,1-3H3
InChIKeyDPQWAHYYAKLJER-UHFFFAOYSA-N
XLogP1.43
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[benzyl(methyl)amino]-3-[2,2-dimethylpropyl(methyl)amino]propan-2-ol
CID 110929932
1-[(4-bromophenyl)methyl-methylamino]-3-phenylpropan-2-ol
CID 112810893
1-[benzyl(methyl)amino]-3-[(3,4-dimethoxyphenyl)methyl-ethylamino]propan-2-ol
CID 47092518
N-benzyl-N-methylethanamine;N,N-dimethylethanamine;ethane
CID 159486837
1-[benzyl(methyl)amino]-3-[methyl(oxan-4-yl)amino]propan-2-ol
CID 111613392
1-[benzyl(methyl)amino]-5-methylhexane-2,3,4-triol
CID 153440075
3-[benzyl(methyl)amino]-1,1,1-trifluoropropan-2-ol
CID 2765888
3-[benzyl(methyl)amino]-1,1-diphenylpropan-2-ol
CID 12549048
1-[benzyl(methyl)amino]-3-[methyl(1,2,3,4-tetrahydronaphthalen-2-yl)amino]propan-2-ol
CID 86952535
N,N-dimethyl-1-phenylmethanamine;N-ethyl-N-methylethanamine
CID 154948707
1-[benzyl(methyl)amino]-3-(4-methoxyphenoxy)propan-2-ol
CID 110877486
1-[benzyl(methyl)amino]-3-(2-methylphenoxy)propan-2-ol
CID 117067141

Frequently Asked Questions

What is the IUPAC name of 1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol?
The IUPAC name of 1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol (CID 110929931) is 1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol.
What is the SMILES notation for 1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol?
The canonical SMILES for 1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol is CCN(C)CC(O)CN(C)Cc1ccccc1.
What is the InChIKey of 1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol?
The InChIKey is DPQWAHYYAKLJER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-15(2)11-14(17)12-16(3)10-13-8-6-5-7-9-13/h5-9,14,17H,4,10-12H2,1-3H3.
What are the key properties of 1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol?
1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol has a molecular weight of 236.36 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[benzyl(methyl)amino]-3-[ethyl(methyl)amino]propan-2-ol is sourced from PubChem (CID 110929931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).