2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine

C15H34N2O — CID 114867538

IUPAC2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine
SMILESCOCC(C)N(C)C(CN)(CC(C)C)CC(C)C
InChIInChI=1S/C15H34N2O/c1-12(2)8-15(11-16,9-13(3)4)17(6)14(5)10-18-7/h12-14H,8-11,16H2,1-7H3
InChIKeyWGLDLUJHSLDSTF-UHFFFAOYSA-N
MW258.45 g/mol
LogP2.74
Rot. Bonds9

About 2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine

2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine (PubChem CID 114867538) has the molecular formula C15H34N2O and a molecular weight of 258.45 g/mol. Its IUPAC name is 2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine.

Molecular Properties

Compound Name2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine
PubChem CID114867538
Molecular FormulaC15H34N2O
Molecular Weight258.45 g/mol
Exact Mass258.27
IUPAC Name2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine
SMILESCOCC(C)N(C)C(CN)(CC(C)C)CC(C)C
InChIInChI=1S/C15H34N2O/c1-12(2)8-15(11-16,9-13(3)4)17(6)14(5)10-18-7/h12-14H,8-11,16H2,1-7H3
InChIKeyWGLDLUJHSLDSTF-UHFFFAOYSA-N
XLogP2.74
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.45
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N,4-dimethyl-2-(2-methylpropyl)-2-N-pentan-3-ylpentane-1,2-diamine
CID 114867441
2-N-butan-2-yl-2-N-(2-methoxyethyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine
CID 114867563
2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-methyl-2-(2-methylpropyl)pentane-1,2-diamine
CID 114867556
4-methyl-2-(2-methylpropyl)-2-N,2-N-dipropylpentane-1,2-diamine
CID 115576499
2,2-diethyl-N'-(1-methoxypropan-2-yl)-N'-methylpropane-1,3-diamine
CID 62257958
N'-(1-methoxypropan-2-yl)-N'-methylethane-1,2-diamine
CID 61453398
2-N,4-dimethyl-2-N-(4-methylcyclohexyl)-2-(2-methylpropyl)pentane-1,2-diamine
CID 114867517
1-amino-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-2-ol
CID 64821364
N-ethyl-1-methoxy-N-methylpropan-2-amine
CID 142890650
(2S)-1-[1-methoxypropan-2-yl(methyl)amino]propan-2-ol
CID 103935012
2-benzyl-2-N-ethyl-2-N-(1-methoxypropan-2-yl)butane-1,2-diamine
CID 79008492
4-(4-methoxyphenyl)-2-N-(1-methoxypropan-2-yl)-2-N,2-dimethylbutane-1,2-diamine
CID 61453212

Frequently Asked Questions

What is the IUPAC name of 2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine?
The IUPAC name of 2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine (CID 114867538) is 2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine.
What is the SMILES notation for 2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine?
The canonical SMILES for 2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine is COCC(C)N(C)C(CN)(CC(C)C)CC(C)C.
What is the InChIKey of 2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine?
The InChIKey is WGLDLUJHSLDSTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N2O/c1-12(2)8-15(11-16,9-13(3)4)17(6)14(5)10-18-7/h12-14H,8-11,16H2,1-7H3.
What are the key properties of 2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine?
2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine has a molecular weight of 258.45 g/mol, XLogP of 2.74, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-methoxypropan-2-yl)-2-N,4-dimethyl-2-(2-methylpropyl)pentane-1,2-diamine is sourced from PubChem (CID 114867538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).