N-[1-(4-propylphenyl)ethyl]propan-1-amine

C14H23N — CID 43185206

IUPACN-[1-(4-propylphenyl)ethyl]propan-1-amine
SMILESCCCNC(C)c1ccc(CCC)cc1
InChIInChI=1S/C14H23N/c1-4-6-13-7-9-14(10-8-13)12(3)15-11-5-2/h7-10,12,15H,4-6,11H2,1-3H3
InChIKeyLXOUJLKYAUIABQ-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.70
Rot. Bonds6

About N-[1-(4-propylphenyl)ethyl]propan-1-amine

N-[1-(4-propylphenyl)ethyl]propan-1-amine (PubChem CID 43185206) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is N-[1-(4-propylphenyl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(4-propylphenyl)ethyl]propan-1-amine
PubChem CID43185206
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC NameN-[1-(4-propylphenyl)ethyl]propan-1-amine
SMILESCCCNC(C)c1ccc(CCC)cc1
InChIInChI=1S/C14H23N/c1-4-6-13-7-9-14(10-8-13)12(3)15-11-5-2/h7-10,12,15H,4-6,11H2,1-3H3
InChIKeyLXOUJLKYAUIABQ-UHFFFAOYSA-N
XLogP3.70
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(4-ethylphenyl)ethyl]propan-1-amine
CID 43185208
N-[1-(4-propylphenyl)ethyl]pent-3-yn-1-amine
CID 116642928
3-propan-2-yloxy-N-[1-(4-propylphenyl)ethyl]propan-1-amine
CID 43102654
N-(2-ethylsulfinylethyl)-1-(4-propylphenyl)ethanamine
CID 115718883
(2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol
CID 103906705
N-[(4-ethylphenyl)methyl]-1-(4-propylphenyl)ethanamine
CID 106899436
N'-methyl-N'-propan-2-yl-N-[1-(4-propylphenyl)ethyl]propane-1,3-diamine
CID 106040066
3-methylsulfonyl-N-[1-(4-propylphenyl)ethyl]propan-1-amine
CID 54905763
N-[1-(3-propylphenyl)ethyl]propan-1-amine
CID 116544021
2-(propylamino)-1-(4-propylphenyl)propan-1-ol
CID 82316044
N-[1-[4-(4-ethylphenoxy)phenyl]ethyl]propan-1-amine
CID 43285379
3-(2-methoxyethoxy)-N-[1-(4-propylphenyl)ethyl]propan-1-amine
CID 43206900

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-propylphenyl)ethyl]propan-1-amine?
The IUPAC name of N-[1-(4-propylphenyl)ethyl]propan-1-amine (CID 43185206) is N-[1-(4-propylphenyl)ethyl]propan-1-amine.
What is the SMILES notation for N-[1-(4-propylphenyl)ethyl]propan-1-amine?
The canonical SMILES for N-[1-(4-propylphenyl)ethyl]propan-1-amine is CCCNC(C)c1ccc(CCC)cc1.
What is the InChIKey of N-[1-(4-propylphenyl)ethyl]propan-1-amine?
The InChIKey is LXOUJLKYAUIABQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-4-6-13-7-9-14(10-8-13)12(3)15-11-5-2/h7-10,12,15H,4-6,11H2,1-3H3.
What are the key properties of N-[1-(4-propylphenyl)ethyl]propan-1-amine?
N-[1-(4-propylphenyl)ethyl]propan-1-amine has a molecular weight of 205.34 g/mol, XLogP of 3.70, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-propylphenyl)ethyl]propan-1-amine is sourced from PubChem (CID 43185206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).