(2R)-2,4-dimethyl-4-phenylpentan-1-amine

C13H21N — CID 42077880

IUPAC(2R)-2,4-dimethyl-4-phenylpentan-1-amine
SMILESC[C@@H](CN)CC(C)(C)c1ccccc1
InChIInChI=1S/C13H21N/c1-11(10-14)9-13(2,3)12-7-5-4-6-8-12/h4-8,11H,9-10,14H2,1-3H3/t11-/m1/s1
InChIKeyCZAPDMVNYNSQTB-LLVKDONJSA-N
MW191.32 g/mol
LogP2.95
Rot. Bonds4

About (2R)-2,4-dimethyl-4-phenylpentan-1-amine

(2R)-2,4-dimethyl-4-phenylpentan-1-amine (PubChem CID 42077880) has the molecular formula C13H21N and a molecular weight of 191.32 g/mol. Its IUPAC name is (2R)-2,4-dimethyl-4-phenylpentan-1-amine.

Molecular Properties

Compound Name(2R)-2,4-dimethyl-4-phenylpentan-1-amine
PubChem CID42077880
Molecular FormulaC13H21N
Molecular Weight191.32 g/mol
Exact Mass191.17
IUPAC Name(2R)-2,4-dimethyl-4-phenylpentan-1-amine
SMILESC[C@@H](CN)CC(C)(C)c1ccccc1
InChIInChI=1S/C13H21N/c1-11(10-14)9-13(2,3)12-7-5-4-6-8-12/h4-8,11H,9-10,14H2,1-3H3/t11-/m1/s1
InChIKeyCZAPDMVNYNSQTB-LLVKDONJSA-N
XLogP2.95
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.32
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-4-methyl-4-phenylpentan-2-ol
CID 69029171
(2R)-N,4-dimethyl-4-phenylpentan-2-amine
CID 42077724
N,N,4-trimethyl-4-phenylpentan-2-amine
CID 142069190
2-amino-4-methyl-4-phenylpentanoic acid
CID 11287233
2,4,6,8-tetramethyl-2,8-diphenylnonan-5-one
CID 150218147
4-methyl-4-phenyl-N-[(1R)-1-phenylethyl]pentan-2-amine
CID 81351069
5-amino-4,4-diphenylpentan-2-ol
CID 24973034
4-amino-2,3-dimethyl-2-phenylbutanoic acid
CID 143150739
N-but-2-ynyl-4-methyl-4-phenylpentan-2-amine
CID 115906615
N-(4-methyl-4-phenylpentan-2-yl)pyrrol-1-amine
CID 79090233
4-amino-3-methoxy-N-(4-methyl-4-phenylpentan-2-yl)butanamide;hydrochloride
CID 120590624
2-methyl-3-phenylpropan-1-amine
CID 12672558

Frequently Asked Questions

What is the IUPAC name of (2R)-2,4-dimethyl-4-phenylpentan-1-amine?
The IUPAC name of (2R)-2,4-dimethyl-4-phenylpentan-1-amine (CID 42077880) is (2R)-2,4-dimethyl-4-phenylpentan-1-amine.
What is the SMILES notation for (2R)-2,4-dimethyl-4-phenylpentan-1-amine?
The canonical SMILES for (2R)-2,4-dimethyl-4-phenylpentan-1-amine is C[C@@H](CN)CC(C)(C)c1ccccc1.
What is the InChIKey of (2R)-2,4-dimethyl-4-phenylpentan-1-amine?
The InChIKey is CZAPDMVNYNSQTB-LLVKDONJSA-N. The full InChI is InChI=1S/C13H21N/c1-11(10-14)9-13(2,3)12-7-5-4-6-8-12/h4-8,11H,9-10,14H2,1-3H3/t11-/m1/s1.
What are the key properties of (2R)-2,4-dimethyl-4-phenylpentan-1-amine?
(2R)-2,4-dimethyl-4-phenylpentan-1-amine has a molecular weight of 191.32 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2,4-dimethyl-4-phenylpentan-1-amine is sourced from PubChem (CID 42077880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).