ethane;N,N,3-trimethylcyclobutan-1-amine

C11H27N — CID 170739396

IUPACethane;N,N,3-trimethylcyclobutan-1-amine
SMILESCC.CC.CC1CC(N(C)C)C1
InChIInChI=1S/C7H15N.2C2H6/c1-6-4-7(5-6)8(2)3;2*1-2/h6-7H,4-5H2,1-3H3;2*1-2H3
InChIKeyXLSRCOQNNJCTMS-UHFFFAOYSA-N
MW173.34 g/mol
LogP3.40
Rot. Bonds1

About ethane;N,N,3-trimethylcyclobutan-1-amine

ethane;N,N,3-trimethylcyclobutan-1-amine (PubChem CID 170739396) has the molecular formula C11H27N and a molecular weight of 173.34 g/mol. Its IUPAC name is ethane;N,N,3-trimethylcyclobutan-1-amine.

Molecular Properties

Compound Nameethane;N,N,3-trimethylcyclobutan-1-amine
PubChem CID170739396
Molecular FormulaC11H27N
Molecular Weight173.34 g/mol
Exact Mass173.21
IUPAC Nameethane;N,N,3-trimethylcyclobutan-1-amine
SMILESCC.CC.CC1CC(N(C)C)C1
InChIInChI=1S/C7H15N.2C2H6/c1-6-4-7(5-6)8(2)3;2*1-2/h6-7H,4-5H2,1-3H3;2*1-2H3
InChIKeyXLSRCOQNNJCTMS-UHFFFAOYSA-N
XLogP3.40
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.34
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

cis-(3S,5R)-N,N,3,5-tetramethylcyclohexan-1-amine;ethane;methanol
CID 145399725
ethane;N,N,3-trimethylcyclopentan-1-amine
CID 91598782
cis-(1R,3S)-N,N,3-trimethylcyclohexan-1-amine
CID 142193437
methane;N,N,4-trimethylcyclohexan-1-amine
CID 159051583
N,N-diethyl-3-methylcyclobutan-1-amine
CID 123585979
N,N-dimethylcyclobutanamine;N,N-dimethylmethanamine;ethane
CID 143754899
trans-(1S,3S)-1-N,1-N,3-N,3-N-tetramethylcyclohexane-1,3-diamine
CID 101240385
N-(2,2-dimethylpropyl)-N,3-dimethylcyclobutan-1-amine
CID 131161615
ethane;2-methoxy-N,N,6-trimethyloxan-4-amine
CID 143454744
1,1-difluoro-2,4,6-trimethylcyclohexane
CID 161062505
N,N-dimethyloxetan-3-amine;ethane
CID 142330300
ethane;3-methylbicyclo[3.1.0]hexane
CID 143195876

Frequently Asked Questions

What is the IUPAC name of ethane;N,N,3-trimethylcyclobutan-1-amine?
The IUPAC name of ethane;N,N,3-trimethylcyclobutan-1-amine (CID 170739396) is ethane;N,N,3-trimethylcyclobutan-1-amine.
What is the SMILES notation for ethane;N,N,3-trimethylcyclobutan-1-amine?
The canonical SMILES for ethane;N,N,3-trimethylcyclobutan-1-amine is CC.CC.CC1CC(N(C)C)C1.
What is the InChIKey of ethane;N,N,3-trimethylcyclobutan-1-amine?
The InChIKey is XLSRCOQNNJCTMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.2C2H6/c1-6-4-7(5-6)8(2)3;2*1-2/h6-7H,4-5H2,1-3H3;2*1-2H3.
What are the key properties of ethane;N,N,3-trimethylcyclobutan-1-amine?
ethane;N,N,3-trimethylcyclobutan-1-amine has a molecular weight of 173.34 g/mol, XLogP of 3.40, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N,N,3-trimethylcyclobutan-1-amine is sourced from PubChem (CID 170739396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).