N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine

C14H23N — CID 164863400

IUPACN,2-dimethyl-4-(4-methylphenyl)pentan-2-amine
SMILESCNC(C)(C)CC(C)c1ccc(C)cc1
InChIInChI=1S/C14H23N/c1-11-6-8-13(9-7-11)12(2)10-14(3,4)15-5/h6-9,12,15H,10H2,1-5H3
InChIKeyBFTDKOGXDNWIAG-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.49
Rot. Bonds4

About N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine

N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine (PubChem CID 164863400) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine.

Molecular Properties

Compound NameN,2-dimethyl-4-(4-methylphenyl)pentan-2-amine
PubChem CID164863400
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC NameN,2-dimethyl-4-(4-methylphenyl)pentan-2-amine
SMILESCNC(C)(C)CC(C)c1ccc(C)cc1
InChIInChI=1S/C14H23N/c1-11-6-8-13(9-7-11)12(2)10-14(3,4)15-5/h6-9,12,15H,10H2,1-5H3
InChIKeyBFTDKOGXDNWIAG-UHFFFAOYSA-N
XLogP3.49
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-4-(4-methylphenyl)pentan-2-ol
CID 11041610
2-ethyl-2-methyl-4-(4-methylphenyl)pentanoic acid
CID 155645520
1-[4,6-bis(4-methylphenyl)heptan-2-yl]-4-methylbenzene
CID 164713773
N-methyl-3-(4-methylphenyl)butanamide
CID 82075625
[(2R)-4,4-dimethylpentan-2-yl]benzene;bis(1-[(2R)-4,4-dimethylpentan-2-yl]-4-methylbenzene);2,2-dimethylpropylcyclopropane
CID 158923341
(6S)-4-ethyl-2-methyl-6-(4-methylphenyl)heptan-2-ol
CID 126614779
1-[(2S)-3,3-dimethylbutan-2-yl]-4-methylbenzene
CID 58051727
N,N-dimethyl-2-(4-methylphenyl)propan-1-amine
CID 143373779
1-(4-bromopentan-2-yl)-4-methylbenzene
CID 64718589
(2S,4R)-4-(4-methylphenyl)pentan-2-amine
CID 11789769
1-butan-2-yl-4-methylbenzene;molecular hydrogen;propane
CID 144517328
(3R)-N,3-bis(4-methylphenyl)butanamide
CID 7054484

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine?
The IUPAC name of N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine (CID 164863400) is N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine.
What is the SMILES notation for N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine?
The canonical SMILES for N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine is CNC(C)(C)CC(C)c1ccc(C)cc1.
What is the InChIKey of N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine?
The InChIKey is BFTDKOGXDNWIAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-11-6-8-13(9-7-11)12(2)10-14(3,4)15-5/h6-9,12,15H,10H2,1-5H3.
What are the key properties of N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine?
N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine has a molecular weight of 205.34 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-4-(4-methylphenyl)pentan-2-amine is sourced from PubChem (CID 164863400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).