ethane;methanamine;N,N,3-trimethylbutan-1-amine

C10H28N2 — CID 143170086

IUPACethane;methanamine;N,N,3-trimethylbutan-1-amine
SMILESCC.CC(C)CCN(C)C.CN
InChIInChI=1S/C7H17N.C2H6.CH5N/c1-7(2)5-6-8(3)4;2*1-2/h7H,5-6H2,1-4H3;1-2H3;2H2,1H3
InChIKeyCFKDFTMVRRPIPT-UHFFFAOYSA-N
MW176.35 g/mol
LogP2.20
Rot. Bonds3

About ethane;methanamine;N,N,3-trimethylbutan-1-amine

ethane;methanamine;N,N,3-trimethylbutan-1-amine (PubChem CID 143170086) has the molecular formula C10H28N2 and a molecular weight of 176.35 g/mol. Its IUPAC name is ethane;methanamine;N,N,3-trimethylbutan-1-amine.

Molecular Properties

Compound Nameethane;methanamine;N,N,3-trimethylbutan-1-amine
PubChem CID143170086
Molecular FormulaC10H28N2
Molecular Weight176.35 g/mol
Exact Mass176.23
IUPAC Nameethane;methanamine;N,N,3-trimethylbutan-1-amine
SMILESCC.CC(C)CCN(C)C.CN
InChIInChI=1S/C7H17N.C2H6.CH5N/c1-7(2)5-6-8(3)4;2*1-2/h7H,5-6H2,1-4H3;1-2H3;2H2,1H3
InChIKeyCFKDFTMVRRPIPT-UHFFFAOYSA-N
XLogP2.20
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.35
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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N,N,N',N'-tetrakis(2-methylpropyl)ethane-1,2-diamine
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CID 23198614
ethane;3-methoxy-N,N-dimethylbutan-1-amine
CID 144600046
N,N,20-trimethylhenicosan-1-amine;hydrochloride
CID 173055097
N,3-dimethyl-N-propylbutan-1-amine;ethane
CID 143004983
3-fluoro-N,N-dimethylbutan-1-amine
CID 142449569
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Frequently Asked Questions

What is the IUPAC name of ethane;methanamine;N,N,3-trimethylbutan-1-amine?
The IUPAC name of ethane;methanamine;N,N,3-trimethylbutan-1-amine (CID 143170086) is ethane;methanamine;N,N,3-trimethylbutan-1-amine.
What is the SMILES notation for ethane;methanamine;N,N,3-trimethylbutan-1-amine?
The canonical SMILES for ethane;methanamine;N,N,3-trimethylbutan-1-amine is CC.CC(C)CCN(C)C.CN.
What is the InChIKey of ethane;methanamine;N,N,3-trimethylbutan-1-amine?
The InChIKey is CFKDFTMVRRPIPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N.C2H6.CH5N/c1-7(2)5-6-8(3)4;2*1-2/h7H,5-6H2,1-4H3;1-2H3;2H2,1H3.
What are the key properties of ethane;methanamine;N,N,3-trimethylbutan-1-amine?
ethane;methanamine;N,N,3-trimethylbutan-1-amine has a molecular weight of 176.35 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methanamine;N,N,3-trimethylbutan-1-amine is sourced from PubChem (CID 143170086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).