propane;N,N,3-trimethylbutan-1-amine

C10H25N — CID 144828505

IUPACpropane;N,N,3-trimethylbutan-1-amine
SMILESCC(C)CCN(C)C.CCC
InChIInChI=1S/C7H17N.C3H8/c1-7(2)5-6-8(3)4;1-3-2/h7H,5-6H2,1-4H3;3H2,1-2H3
InChIKeyDMJKFGBWVSUTHI-UHFFFAOYSA-N
MW159.32 g/mol
LogP3.01
Rot. Bonds3

About propane;N,N,3-trimethylbutan-1-amine

propane;N,N,3-trimethylbutan-1-amine (PubChem CID 144828505) has the molecular formula C10H25N and a molecular weight of 159.32 g/mol. Its IUPAC name is propane;N,N,3-trimethylbutan-1-amine.

Molecular Properties

Compound Namepropane;N,N,3-trimethylbutan-1-amine
PubChem CID144828505
Molecular FormulaC10H25N
Molecular Weight159.32 g/mol
Exact Mass159.20
IUPAC Namepropane;N,N,3-trimethylbutan-1-amine
SMILESCC(C)CCN(C)C.CCC
InChIInChI=1S/C7H17N.C3H8/c1-7(2)5-6-8(3)4;1-3-2/h7H,5-6H2,1-4H3;3H2,1-2H3
InChIKeyDMJKFGBWVSUTHI-UHFFFAOYSA-N
XLogP3.01
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.32
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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3-fluoro-N,N-dimethylbutan-1-amine
CID 142449569
methane;1,2,3,5-tetramethylbenzene;N,N,3-trimethylbutan-1-amine
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1-N,1-N,3-N,7-tetramethyloctane-1,3-diamine
CID 83160965
ethane;1-N,1-N,4-N-trimethyl-4-N-(4-methylpentyl)pentane-1,4-diamine
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1-[4-(dimethylamino)butan-2-yl-methylamino]ethanol
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Frequently Asked Questions

What is the IUPAC name of propane;N,N,3-trimethylbutan-1-amine?
The IUPAC name of propane;N,N,3-trimethylbutan-1-amine (CID 144828505) is propane;N,N,3-trimethylbutan-1-amine.
What is the SMILES notation for propane;N,N,3-trimethylbutan-1-amine?
The canonical SMILES for propane;N,N,3-trimethylbutan-1-amine is CC(C)CCN(C)C.CCC.
What is the InChIKey of propane;N,N,3-trimethylbutan-1-amine?
The InChIKey is DMJKFGBWVSUTHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N.C3H8/c1-7(2)5-6-8(3)4;1-3-2/h7H,5-6H2,1-4H3;3H2,1-2H3.
What are the key properties of propane;N,N,3-trimethylbutan-1-amine?
propane;N,N,3-trimethylbutan-1-amine has a molecular weight of 159.32 g/mol, XLogP of 3.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for propane;N,N,3-trimethylbutan-1-amine is sourced from PubChem (CID 144828505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).