N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine

C15H30N2 — CID 107473291

IUPACN'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine
SMILESCC(C)(C)CC(CN)CNC(C1CC1)C1CC1
InChIInChI=1S/C15H30N2/c1-15(2,3)8-11(9-16)10-17-14(12-4-5-12)13-6-7-13/h11-14,17H,4-10,16H2,1-3H3
InChIKeyATJPYEARPLWCHX-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.78
Rot. Bonds7

About N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine

N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine (PubChem CID 107473291) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine
PubChem CID107473291
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine
SMILESCC(C)(C)CC(CN)CNC(C1CC1)C1CC1
InChIInChI=1S/C15H30N2/c1-15(2,3)8-11(9-16)10-17-14(12-4-5-12)13-6-7-13/h11-14,17H,4-10,16H2,1-3H3
InChIKeyATJPYEARPLWCHX-UHFFFAOYSA-N
XLogP2.78
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(3-cyclopropylpropyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine
CID 107473665
2-(2,2-dimethylpropyl)-N'-(3-tricyclo[3.2.1.02,4]octanyl)propane-1,3-diamine
CID 114096311
2-(2,2-dimethylpropyl)-N'-(4-methylcycloheptyl)propane-1,3-diamine
CID 114100507
N'-(2,3-dimethylbutyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine
CID 107473500
1-cyclopropyl-N,N-diethylethane-1,2-diamine
CID 43654980
(2R)-1-(dicyclopropylmethylamino)propan-2-ol
CID 93082129
N'-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)-N'-methylpropane-1,3-diamine
CID 107473176
N-(dicyclopropylmethyl)-2-methylsulfinylpropan-1-amine
CID 115896301
2-cyclopropyl-N,4,4-trimethylpentan-1-amine
CID 83827155
1-N-(dicyclopropylmethyl)-2-N,2-dimethylpropane-1,2-diamine
CID 62847502
N'-cyclopropyl-2-(2,2-dimethylpropyl)-N'-(2-methylpropyl)propane-1,3-diamine
CID 107473311
3-[[2-(aminomethyl)-4,4-dimethylpentanoyl]amino]-3-cyclopropylpropanoic acid
CID 107472588

Frequently Asked Questions

What is the IUPAC name of N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine?
The IUPAC name of N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine (CID 107473291) is N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine.
What is the SMILES notation for N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine?
The canonical SMILES for N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine is CC(C)(C)CC(CN)CNC(C1CC1)C1CC1.
What is the InChIKey of N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine?
The InChIKey is ATJPYEARPLWCHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-15(2,3)8-11(9-16)10-17-14(12-4-5-12)13-6-7-13/h11-14,17H,4-10,16H2,1-3H3.
What are the key properties of N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine?
N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine has a molecular weight of 238.42 g/mol, XLogP of 2.78, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(dicyclopropylmethyl)-2-(2,2-dimethylpropyl)propane-1,3-diamine is sourced from PubChem (CID 107473291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).