2,3-dimethylpentane;N-methylpropan-1-amine

C11H27N — CID 162382755

IUPAC2,3-dimethylpentane;N-methylpropan-1-amine
SMILESCCC(C)C(C)C.CCCNC
InChIInChI=1S/C7H16.C4H11N/c1-5-7(4)6(2)3;1-3-4-5-2/h6-7H,5H2,1-4H3;5H,3-4H2,1-2H3
InChIKeyIFGFUAILBPBQIA-UHFFFAOYSA-N
MW173.34 g/mol
LogP3.30
Rot. Bonds4

About 2,3-dimethylpentane;N-methylpropan-1-amine

2,3-dimethylpentane;N-methylpropan-1-amine (PubChem CID 162382755) has the molecular formula C11H27N and a molecular weight of 173.34 g/mol. Its IUPAC name is 2,3-dimethylpentane;N-methylpropan-1-amine.

Molecular Properties

Compound Name2,3-dimethylpentane;N-methylpropan-1-amine
PubChem CID162382755
Molecular FormulaC11H27N
Molecular Weight173.34 g/mol
Exact Mass173.21
IUPAC Name2,3-dimethylpentane;N-methylpropan-1-amine
SMILESCCC(C)C(C)C.CCCNC
InChIInChI=1S/C7H16.C4H11N/c1-5-7(4)6(2)3;1-3-4-5-2/h6-7H,5H2,1-4H3;5H,3-4H2,1-2H3
InChIKeyIFGFUAILBPBQIA-UHFFFAOYSA-N
XLogP3.30
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.34
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-dimethylbutane;2,3-dimethylpentane;methanethiol
CID 171505915
bis(2,3-dimethylpentane);tetrakis(2-methylbutane)
CID 158387932
2,3-dimethylpentane;ethane;methane
CID 143379754
2,3-dimethylbutane;2,3-dimethylpentane;2,4-dimethylpentane
CID 159853039
ethane;N,3,4-trimethylhexan-1-amine
CID 145138668
fluoroethane;N-methylpropan-1-amine
CID 142447167
(3R)-2,3-dimethylpentane;ethane;ethene
CID 178131669
cyclobutane;2,3-dimethylpentane
CID 145154125
butan-2-yl carbamate;N-methylpropan-1-amine
CID 175421814
ethene;N-methylethanamine;N-methylpropan-1-amine
CID 143374724
(4S)-2,3,4-trimethylhexane
CID 58359072
bis(2,3-dimethylpentane);ethane;bis(2-methylbutane);bis(2-methylpentane)
CID 160533172

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylpentane;N-methylpropan-1-amine?
The IUPAC name of 2,3-dimethylpentane;N-methylpropan-1-amine (CID 162382755) is 2,3-dimethylpentane;N-methylpropan-1-amine.
What is the SMILES notation for 2,3-dimethylpentane;N-methylpropan-1-amine?
The canonical SMILES for 2,3-dimethylpentane;N-methylpropan-1-amine is CCC(C)C(C)C.CCCNC.
What is the InChIKey of 2,3-dimethylpentane;N-methylpropan-1-amine?
The InChIKey is IFGFUAILBPBQIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16.C4H11N/c1-5-7(4)6(2)3;1-3-4-5-2/h6-7H,5H2,1-4H3;5H,3-4H2,1-2H3.
What are the key properties of 2,3-dimethylpentane;N-methylpropan-1-amine?
2,3-dimethylpentane;N-methylpropan-1-amine has a molecular weight of 173.34 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylpentane;N-methylpropan-1-amine is sourced from PubChem (CID 162382755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).