ethane;N-ethyl-N-propylpentan-2-amine

C12H29N — CID 165399602

IUPACethane;N-ethyl-N-propylpentan-2-amine
SMILESCC.CCCC(C)N(CC)CCC
InChIInChI=1S/C10H23N.C2H6/c1-5-8-10(4)11(7-3)9-6-2;1-2/h10H,5-9H2,1-4H3;1-2H3
InChIKeyUZTKKJWYAXKDFI-UHFFFAOYSA-N
MW187.37 g/mol
LogP3.93
Rot. Bonds6

About ethane;N-ethyl-N-propylpentan-2-amine

ethane;N-ethyl-N-propylpentan-2-amine (PubChem CID 165399602) has the molecular formula C12H29N and a molecular weight of 187.37 g/mol. Its IUPAC name is ethane;N-ethyl-N-propylpentan-2-amine.

Molecular Properties

Compound Nameethane;N-ethyl-N-propylpentan-2-amine
PubChem CID165399602
Molecular FormulaC12H29N
Molecular Weight187.37 g/mol
Exact Mass187.23
IUPAC Nameethane;N-ethyl-N-propylpentan-2-amine
SMILESCC.CCCC(C)N(CC)CCC
InChIInChI=1S/C10H23N.C2H6/c1-5-8-10(4)11(7-3)9-6-2;1-2/h10H,5-9H2,1-4H3;1-2H3
InChIKeyUZTKKJWYAXKDFI-UHFFFAOYSA-N
XLogP3.93
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.37
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-bromoethyl)-N-ethylpentan-2-amine
CID 107887496
ethane;3-N-ethyl-1-N,1-N-dimethyl-3-N-propylbutane-1,3-diamine
CID 142088421
N-(3-bromopropyl)-N-ethylpentan-2-amine
CID 107887563
N-ethyl-N-propylicosan-2-amine
CID 172693354
2-N-ethyl-2-N-propylpropane-1,2-diamine
CID 43268522
2-N,2-N,5-N,5-N-tetraethylhexane-2,5-diamine
CID 87407207
N,N-dipropylbutan-2-amine;ethane;propane
CID 143577846
N,N'-diethyl-N'-pentan-2-ylmethanediamine
CID 156888223
N,N-dibutylpentan-2-amine;hydrate
CID 172857272
2-[2-hydroxyethyl(pentan-2-yl)amino]ethanol
CID 107886008
1-N,1-N,1-N',1-N'-tetrapropylethane-1,1-diamine
CID 141222296
N,N-dipropylbutan-2-amine
CID 524229

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-N-propylpentan-2-amine?
The IUPAC name of ethane;N-ethyl-N-propylpentan-2-amine (CID 165399602) is ethane;N-ethyl-N-propylpentan-2-amine.
What is the SMILES notation for ethane;N-ethyl-N-propylpentan-2-amine?
The canonical SMILES for ethane;N-ethyl-N-propylpentan-2-amine is CC.CCCC(C)N(CC)CCC.
What is the InChIKey of ethane;N-ethyl-N-propylpentan-2-amine?
The InChIKey is UZTKKJWYAXKDFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N.C2H6/c1-5-8-10(4)11(7-3)9-6-2;1-2/h10H,5-9H2,1-4H3;1-2H3.
What are the key properties of ethane;N-ethyl-N-propylpentan-2-amine?
ethane;N-ethyl-N-propylpentan-2-amine has a molecular weight of 187.37 g/mol, XLogP of 3.93, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-N-propylpentan-2-amine is sourced from PubChem (CID 165399602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).