N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine

C15H34N2 — CID 62259022

IUPACN,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine
SMILESCCCC(C)(CNC)CN(CC(C)C)C(C)C
InChIInChI=1S/C15H34N2/c1-8-9-15(6,11-16-7)12-17(14(4)5)10-13(2)3/h13-14,16H,8-12H2,1-7H3
InChIKeyBIOFIHQKHKKFCS-UHFFFAOYSA-N
MW242.45 g/mol
LogP3.38
Rot. Bonds9

About N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine

N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine (PubChem CID 62259022) has the molecular formula C15H34N2 and a molecular weight of 242.45 g/mol. Its IUPAC name is N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine.

Molecular Properties

Compound NameN,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine
PubChem CID62259022
Molecular FormulaC15H34N2
Molecular Weight242.45 g/mol
Exact Mass242.27
IUPAC NameN,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine
SMILESCCCC(C)(CNC)CN(CC(C)C)C(C)C
InChIInChI=1S/C15H34N2/c1-8-9-15(6,11-16-7)12-17(14(4)5)10-13(2)3/h13-14,16H,8-12H2,1-7H3
InChIKeyBIOFIHQKHKKFCS-UHFFFAOYSA-N
XLogP3.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.45
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine
CID 62259708
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-N',2-dimethyl-2-propylpropane-1,3-diamine
CID 103191300
1-[methyl-[2-methyl-2-(methylaminomethyl)pentyl]amino]propan-2-ol
CID 62337356
N-ethyl-2-methyl-N'-(2-methylpropyl)-N'-pentan-3-yl-2-propylpropane-1,3-diamine
CID 79490735
N,N',2-trimethyl-N'-(2-methylbutan-2-yl)-2-propylpropane-1,3-diamine
CID 63967395
N',2-dimethyl-N,N,2-tripropylpropane-1,3-diamine
CID 62264130
2-ethyl-N,2-dimethyl-N'-pentyl-N'-propan-2-ylpropane-1,3-diamine
CID 62259798
2-ethyl-N,N',2-trimethyl-N'-propan-2-ylpropane-1,3-diamine
CID 62263389
N,2-dimethyl-N',2-dipropyl-N'-(2,2,2-trifluoroethyl)propane-1,3-diamine
CID 62256908
2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol
CID 62260772
2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol
CID 62272798
N-[2-(dimethylamino)ethyl]-N'-ethyl-2-methyl-N-(2-methylpropyl)-2-propylpropane-1,3-diamine
CID 62257607

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine?
The IUPAC name of N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine (CID 62259022) is N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine.
What is the SMILES notation for N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine?
The canonical SMILES for N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine is CCCC(C)(CNC)CN(CC(C)C)C(C)C.
What is the InChIKey of N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine?
The InChIKey is BIOFIHQKHKKFCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N2/c1-8-9-15(6,11-16-7)12-17(14(4)5)10-13(2)3/h13-14,16H,8-12H2,1-7H3.
What are the key properties of N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine?
N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine has a molecular weight of 242.45 g/mol, XLogP of 3.38, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine is sourced from PubChem (CID 62259022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).