N-methyl-3-(4-propylphenyl)butan-2-amine

C14H23N — CID 66438296

IUPACN-methyl-3-(4-propylphenyl)butan-2-amine
SMILESCCCc1ccc(C(C)C(C)NC)cc1
InChIInChI=1S/C14H23N/c1-5-6-13-7-9-14(10-8-13)11(2)12(3)15-4/h7-12,15H,5-6H2,1-4H3
InChIKeyWWYPFNMYGMZGQW-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.35
Rot. Bonds5

About N-methyl-3-(4-propylphenyl)butan-2-amine

N-methyl-3-(4-propylphenyl)butan-2-amine (PubChem CID 66438296) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is N-methyl-3-(4-propylphenyl)butan-2-amine.

Molecular Properties

Compound NameN-methyl-3-(4-propylphenyl)butan-2-amine
PubChem CID66438296
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC NameN-methyl-3-(4-propylphenyl)butan-2-amine
SMILESCCCc1ccc(C(C)C(C)NC)cc1
InChIInChI=1S/C14H23N/c1-5-6-13-7-9-14(10-8-13)11(2)12(3)15-4/h7-12,15H,5-6H2,1-4H3
InChIKeyWWYPFNMYGMZGQW-UHFFFAOYSA-N
XLogP3.35
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-1-[4-(4-propylphenyl)phenyl]ethanamine
CID 55198846
1,2-bis(4-propylphenyl)ethane-1,2-dithiol
CID 101102622
2-(methylamino)-2-(4-propylphenyl)ethanethiol
CID 116830608
N-methyl-N'-propan-2-yl-1-(4-propylphenyl)ethane-1,2-diamine
CID 116950451
2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine
CID 79617048
(1S)-1-(4-propylphenyl)ethanamine
CID 7047688
2-methyl-3-(4-propylphenyl)butanoic acid
CID 79730190
methyl 2-hydroxy-3-(4-propylphenyl)butanoate
CID 66287752
N-[1-(4-propylphenyl)ethyl]propan-1-amine
CID 43185206
N,3,3-trimethyl-1-(4-propylphenyl)butan-1-amine
CID 43484923
1-(3-methylhept-4-yn-2-yl)-4-propylbenzene
CID 83921562
1-propyl-4-[(4-propylphenyl)methyl]benzene
CID 4064340

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(4-propylphenyl)butan-2-amine?
The IUPAC name of N-methyl-3-(4-propylphenyl)butan-2-amine (CID 66438296) is N-methyl-3-(4-propylphenyl)butan-2-amine.
What is the SMILES notation for N-methyl-3-(4-propylphenyl)butan-2-amine?
The canonical SMILES for N-methyl-3-(4-propylphenyl)butan-2-amine is CCCc1ccc(C(C)C(C)NC)cc1.
What is the InChIKey of N-methyl-3-(4-propylphenyl)butan-2-amine?
The InChIKey is WWYPFNMYGMZGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-5-6-13-7-9-14(10-8-13)11(2)12(3)15-4/h7-12,15H,5-6H2,1-4H3.
What are the key properties of N-methyl-3-(4-propylphenyl)butan-2-amine?
N-methyl-3-(4-propylphenyl)butan-2-amine has a molecular weight of 205.34 g/mol, XLogP of 3.35, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(4-propylphenyl)butan-2-amine is sourced from PubChem (CID 66438296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).