N,N-dimethyl-1-phenylpropan-1-amine;ethane

C13H23N — CID 144553481

IUPACN,N-dimethyl-1-phenylpropan-1-amine;ethane
SMILESCC.CCC(c1ccccc1)N(C)C
InChIInChI=1S/C11H17N.C2H6/c1-4-11(12(2)3)10-8-6-5-7-9-10;1-2/h5-9,11H,4H2,1-3H3;1-2H3
InChIKeyKEWRYPKXJJZDRD-UHFFFAOYSA-N
MW193.33 g/mol
LogP3.73
Rot. Bonds3

About N,N-dimethyl-1-phenylpropan-1-amine;ethane

N,N-dimethyl-1-phenylpropan-1-amine;ethane (PubChem CID 144553481) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is N,N-dimethyl-1-phenylpropan-1-amine;ethane.

Molecular Properties

Compound NameN,N-dimethyl-1-phenylpropan-1-amine;ethane
PubChem CID144553481
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC NameN,N-dimethyl-1-phenylpropan-1-amine;ethane
SMILESCC.CCC(c1ccccc1)N(C)C
InChIInChI=1S/C11H17N.C2H6/c1-4-11(12(2)3)10-8-6-5-7-9-10;1-2/h5-9,11H,4H2,1-3H3;1-2H3
InChIKeyKEWRYPKXJJZDRD-UHFFFAOYSA-N
XLogP3.73
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-(dimethylamino)-2-phenylethanol
CID 10888273
(1S)-N,N,N',N'-tetramethyl-1-phenylethane-1,2-diamine
CID 134927015
(1S)-3-chloro-N,N-dimethyl-1-phenylpropan-1-amine
CID 141341786
N,N-dimethyl-1-phenylheptan-1-amine
CID 67220027
N,N-dimethyl-1-phenylheptadecan-1-amine;hydrobromide
CID 173082134
N,N-dimethyl-1-phenylnonan-1-amine;hydrochloride
CID 173276058
N,N-bis(1-phenylpropyl)formamide
CID 88549986
1-[3-(aminomethyl)phenyl]-N,N-dimethylpropan-1-amine
CID 116907106
2-[methyl(1-phenylpropyl)amino]butanoic acid
CID 65067637
N-methyl-N-(1-phenylpropyl)pyridin-4-amine
CID 23457999
N,N-dimethyl-1,3-diphenylheptan-1-amine
CID 165348529
methyl N-ethyl-N-[(1R)-1-phenylpropyl]carbamate
CID 143937695

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-phenylpropan-1-amine;ethane?
The IUPAC name of N,N-dimethyl-1-phenylpropan-1-amine;ethane (CID 144553481) is N,N-dimethyl-1-phenylpropan-1-amine;ethane.
What is the SMILES notation for N,N-dimethyl-1-phenylpropan-1-amine;ethane?
The canonical SMILES for N,N-dimethyl-1-phenylpropan-1-amine;ethane is CC.CCC(c1ccccc1)N(C)C.
What is the InChIKey of N,N-dimethyl-1-phenylpropan-1-amine;ethane?
The InChIKey is KEWRYPKXJJZDRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N.C2H6/c1-4-11(12(2)3)10-8-6-5-7-9-10;1-2/h5-9,11H,4H2,1-3H3;1-2H3.
What are the key properties of N,N-dimethyl-1-phenylpropan-1-amine;ethane?
N,N-dimethyl-1-phenylpropan-1-amine;ethane has a molecular weight of 193.33 g/mol, XLogP of 3.73, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-phenylpropan-1-amine;ethane is sourced from PubChem (CID 144553481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).