ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine

C14H31N — CID 166552547

IUPACethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine
SMILESCC.CC(C)N(C)CCC1(C)CCCC1
InChIInChI=1S/C12H25N.C2H6/c1-11(2)13(4)10-9-12(3)7-5-6-8-12;1-2/h11H,5-10H2,1-4H3;1-2H3
InChIKeySDJUXCDVYARHON-UHFFFAOYSA-N
MW213.41 g/mol
LogP4.32
Rot. Bonds4

About ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine

ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine (PubChem CID 166552547) has the molecular formula C14H31N and a molecular weight of 213.41 g/mol. Its IUPAC name is ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine.

Molecular Properties

Compound Nameethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine
PubChem CID166552547
Molecular FormulaC14H31N
Molecular Weight213.41 g/mol
Exact Mass213.25
IUPAC Nameethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine
SMILESCC.CC(C)N(C)CCC1(C)CCCC1
InChIInChI=1S/C12H25N.C2H6/c1-11(2)13(4)10-9-12(3)7-5-6-8-12;1-2/h11H,5-10H2,1-4H3;1-2H3
InChIKeySDJUXCDVYARHON-UHFFFAOYSA-N
XLogP4.32
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.41
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-N-[2-(3-methyloxetan-3-yl)ethyl]propan-2-amine
CID 145201975
N,N-dimethyl-2-(1-methylcyclobutyl)ethanamine;ethane
CID 144987666
N-methyl-N-[2-(1-methyl-3-propan-2-ylcyclobutyl)ethyl]propan-2-amine
CID 170578281
N-methyl-1-[2-[methyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine
CID 167227168
N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen
CID 176704428
3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine
CID 170055778
1-[2-[methyl(propan-2-yl)amino]ethyl]cyclopropan-1-amine
CID 84763773
N-methyl-N-[2-(2-methylazetidin-2-yl)ethyl]propan-2-amine
CID 165404573
N-methyl-N-[2-[1-(trifluoromethyl)cyclopropyl]ethyl]propan-2-amine
CID 178108544
N-[2-[2-(iodomethyl)oxetan-2-yl]ethyl]-N-methylpropan-2-amine
CID 130347240
4-methyl-1-(1-methylcyclohexyl)pentan-3-one
CID 22217356
N-[[1-(bromomethyl)cyclobutyl]methyl]-N-methylpropan-2-amine
CID 65009190

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine?
The IUPAC name of ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine (CID 166552547) is ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine.
What is the SMILES notation for ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine?
The canonical SMILES for ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine is CC.CC(C)N(C)CCC1(C)CCCC1.
What is the InChIKey of ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine?
The InChIKey is SDJUXCDVYARHON-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N.C2H6/c1-11(2)13(4)10-9-12(3)7-5-6-8-12;1-2/h11H,5-10H2,1-4H3;1-2H3.
What are the key properties of ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine?
ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine has a molecular weight of 213.41 g/mol, XLogP of 4.32, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine is sourced from PubChem (CID 166552547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).