N-(1-phenylethyl)hexan-2-amine

C14H23N — CID 43755937

IUPACN-(1-phenylethyl)hexan-2-amine
SMILESCCCCC(C)NC(C)c1ccccc1
InChIInChI=1S/C14H23N/c1-4-5-9-12(2)15-13(3)14-10-7-6-8-11-14/h6-8,10-13,15H,4-5,9H2,1-3H3
InChIKeyDGAACJFRXIEIBF-UHFFFAOYSA-N
MW205.35 g/mol
LogP3.92
Rot. Bonds6

About N-(1-phenylethyl)hexan-2-amine

N-(1-phenylethyl)hexan-2-amine (PubChem CID 43755937) has the molecular formula C14H23N and a molecular weight of 205.35 g/mol. Its IUPAC name is N-(1-phenylethyl)hexan-2-amine.

Molecular Properties

Compound NameN-(1-phenylethyl)hexan-2-amine
PubChem CID43755937
Molecular FormulaC14H23N
Molecular Weight205.35 g/mol
Exact Mass205.18
IUPAC NameN-(1-phenylethyl)hexan-2-amine
SMILESCCCCC(C)NC(C)c1ccccc1
InChIInChI=1S/C14H23N/c1-4-5-9-12(2)15-13(3)14-10-7-6-8-11-14/h6-8,10-13,15H,4-5,9H2,1-3H3
InChIKeyDGAACJFRXIEIBF-UHFFFAOYSA-N
XLogP3.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.35
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4R)-4-[[(1S)-1-phenylethyl]amino]pentan-1-ol
CID 97051530
N-[(1S)-1-pyridin-4-ylethyl]hexan-2-amine
CID 81406053
5-methyl-N-[(1R)-1-phenylethyl]hexan-2-amine
CID 81350765
N-(1-phenylpentyl)octan-2-amine
CID 43791089
N-[(1S)-1-(3-methoxyphenyl)ethyl]hexan-2-amine
CID 81376303
(2S)-4-phenyl-N-[(1R)-1-phenylethyl]butan-2-amine
CID 12814796
N-[(1S)-1-(4-methylphenyl)ethyl]octan-2-amine
CID 81356110
N-[(1S)-1-(4-chlorophenyl)ethyl]heptan-2-amine
CID 81352202
4-[1-(heptan-2-ylamino)ethyl]phenol
CID 43572743
N-[1-(4-propoxyphenyl)ethyl]hexan-2-amine
CID 63476745
N-(1-phenylpropan-2-yl)hexan-2-amine
CID 63012254
N-[1-(4-bromophenyl)ethyl]nonan-2-amine
CID 63454622

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylethyl)hexan-2-amine?
The IUPAC name of N-(1-phenylethyl)hexan-2-amine (CID 43755937) is N-(1-phenylethyl)hexan-2-amine.
What is the SMILES notation for N-(1-phenylethyl)hexan-2-amine?
The canonical SMILES for N-(1-phenylethyl)hexan-2-amine is CCCCC(C)NC(C)c1ccccc1.
What is the InChIKey of N-(1-phenylethyl)hexan-2-amine?
The InChIKey is DGAACJFRXIEIBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-4-5-9-12(2)15-13(3)14-10-7-6-8-11-14/h6-8,10-13,15H,4-5,9H2,1-3H3.
What are the key properties of N-(1-phenylethyl)hexan-2-amine?
N-(1-phenylethyl)hexan-2-amine has a molecular weight of 205.35 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylethyl)hexan-2-amine is sourced from PubChem (CID 43755937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).