4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine

C15H34N2 — CID 114281886

IUPAC4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine
SMILESCCCN(CCC)C(CN)C(C(C)C)C(C)C
InChIInChI=1S/C15H34N2/c1-7-9-17(10-8-2)14(11-16)15(12(3)4)13(5)6/h12-15H,7-11,16H2,1-6H3
InChIKeyYTGNZNGEXNOGLS-UHFFFAOYSA-N
MW242.45 g/mol
LogP3.36
Rot. Bonds9

About 4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine

4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine (PubChem CID 114281886) has the molecular formula C15H34N2 and a molecular weight of 242.45 g/mol. Its IUPAC name is 4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine.

Molecular Properties

Compound Name4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine
PubChem CID114281886
Molecular FormulaC15H34N2
Molecular Weight242.45 g/mol
Exact Mass242.27
IUPAC Name4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine
SMILESCCCN(CCC)C(CN)C(C(C)C)C(C)C
InChIInChI=1S/C15H34N2/c1-7-9-17(10-8-2)14(11-16)15(12(3)4)13(5)6/h12-15H,7-11,16H2,1-6H3
InChIKeyYTGNZNGEXNOGLS-UHFFFAOYSA-N
XLogP3.36
TPSA29.26 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 ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-ethyl-2-N-propylpropane-1,2-diamine
CID 43268522
3-methyl-2-N-propyl-2-N-(2,2,2-trifluoroethyl)pentane-1,2-diamine
CID 114998356
3-methyl-2-N,2-N-bis(3-methylbutyl)hexane-1,2-diamine
CID 107869505
N,N-dipropylbutan-2-amine
CID 524229
1-N,1-N,1-N',1-N'-tetrapropylethane-1,1-diamine
CID 141222296
1-N'-ethyl-1-N'-propylethane-1,1,2-triamine
CID 178182208
1-N-propan-2-yl-1-N-propylbutane-1,3-diamine
CID 43269493
2,2-dimethyl-N'-(2-methylpentan-3-yl)-N'-propylpropane-1,3-diamine
CID 79668130
2-N-(cyclopropylmethyl)-4-methoxy-3-methyl-2-N-propylbutane-1,2-diamine
CID 116501671
2-methyl-N'-propan-2-yl-N'-propylpentane-1,5-diamine
CID 82682516
N,N-dipropylbutan-2-amine;ethane;propane
CID 143577846
3-amino-2-[propan-2-yl(propyl)amino]propan-1-ol
CID 104710820

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine?
The IUPAC name of 4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine (CID 114281886) is 4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine.
What is the SMILES notation for 4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine?
The canonical SMILES for 4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine is CCCN(CCC)C(CN)C(C(C)C)C(C)C.
What is the InChIKey of 4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine?
The InChIKey is YTGNZNGEXNOGLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N2/c1-7-9-17(10-8-2)14(11-16)15(12(3)4)13(5)6/h12-15H,7-11,16H2,1-6H3.
What are the key properties of 4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine?
4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine has a molecular weight of 242.45 g/mol, XLogP of 3.36, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine is sourced from PubChem (CID 114281886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).