2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine

C14H24N2O — CID 112500951

IUPAC2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine
SMILESCC(C)c1ccccc1OCC(CN)N(C)C
InChIInChI=1S/C14H24N2O/c1-11(2)13-7-5-6-8-14(13)17-10-12(9-15)16(3)4/h5-8,11-12H,9-10,15H2,1-4H3
InChIKeyJMJIHTNXQQNTNS-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.08
Rot. Bonds6

About 2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine

2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine (PubChem CID 112500951) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine
PubChem CID112500951
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine
SMILESCC(C)c1ccccc1OCC(CN)N(C)C
InChIInChI=1S/C14H24N2O/c1-11(2)13-7-5-6-8-14(13)17-10-12(9-15)16(3)4/h5-8,11-12H,9-10,15H2,1-4H3
InChIKeyJMJIHTNXQQNTNS-UHFFFAOYSA-N
XLogP2.08
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 ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-1-(2-propan-2-ylphenoxy)propan-2-amine
CID 30814005
1-(2-methylpropoxy)-2-propan-2-ylbenzene
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1-methoxy-3-(2-propan-2-ylphenoxy)propan-2-amine
CID 107506612
(2R)-1-[2-hydroxyethyl(methyl)amino]-3-(2-propan-2-ylphenoxy)propan-2-ol
CID 95232149
2-(methylamino)-3-(2-propan-2-ylphenoxy)propan-1-ol
CID 64804789
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CID 116820498
2-phenyl-4-(2-propan-2-ylphenoxy)butan-1-amine
CID 82137983
2-[2-[3-(2-propan-2-ylphenoxy)propoxy]ethoxy]ethanamine
CID 82353535
3-methyl-4-(2-propan-2-ylphenoxy)butanoic acid
CID 112508341
3-(2-propan-2-ylphenoxy)propanimidamide
CID 24706101
[5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine
CID 62458746
1-(2-ethoxyphenyl)-N-methyl-N-pentan-3-ylethane-1,2-diamine
CID 43570790

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine?
The IUPAC name of 2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine (CID 112500951) is 2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine.
What is the SMILES notation for 2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine?
The canonical SMILES for 2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine is CC(C)c1ccccc1OCC(CN)N(C)C.
What is the InChIKey of 2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine?
The InChIKey is JMJIHTNXQQNTNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-11(2)13-7-5-6-8-14(13)17-10-12(9-15)16(3)4/h5-8,11-12H,9-10,15H2,1-4H3.
What are the key properties of 2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine?
2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine has a molecular weight of 236.36 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-3-(2-propan-2-ylphenoxy)propane-1,2-diamine is sourced from PubChem (CID 112500951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).