2-methyl-1-phenyl-N-propylpentan-3-amine

C15H25N — CID 63561010

IUPAC2-methyl-1-phenyl-N-propylpentan-3-amine
SMILESCCCNC(CC)C(C)Cc1ccccc1
InChIInChI=1S/C15H25N/c1-4-11-16-15(5-2)13(3)12-14-9-7-6-8-10-14/h6-10,13,15-16H,4-5,11-12H2,1-3H3
InChIKeyDASLMYQTIOMPDA-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.64
Rot. Bonds7

About 2-methyl-1-phenyl-N-propylpentan-3-amine

2-methyl-1-phenyl-N-propylpentan-3-amine (PubChem CID 63561010) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 2-methyl-1-phenyl-N-propylpentan-3-amine.

Molecular Properties

Compound Name2-methyl-1-phenyl-N-propylpentan-3-amine
PubChem CID63561010
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name2-methyl-1-phenyl-N-propylpentan-3-amine
SMILESCCCNC(CC)C(C)Cc1ccccc1
InChIInChI=1S/C15H25N/c1-4-11-16-15(5-2)13(3)12-14-9-7-6-8-10-14/h6-10,13,15-16H,4-5,11-12H2,1-3H3
InChIKeyDASLMYQTIOMPDA-UHFFFAOYSA-N
XLogP3.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-iodophenyl)-2-methyl-N-propylpentan-3-amine
CID 65476823
4-benzyl-N-propylhexan-3-amine
CID 79307889
1-(3,4-difluorophenyl)-2-methyl-N-propylpentan-3-amine
CID 82919675
3-benzyl-4-phenyl-N-propylbutan-2-amine
CID 66438552
3-methoxy-4-methyl-1-phenyl-N-propylpentan-2-amine
CID 116720474
4-methyl-7-phenoxy-N-propylheptan-3-amine
CID 63560800
N-[(1S)-1,2-diphenylethyl]propan-1-amine
CID 36689865
3-methyl-1-phenyl-N-propylbut-3-en-2-amine
CID 79191049
(2R)-3-phenyl-2-(propylamino)propan-1-ol
CID 59859919
1-(5-chlorothiophen-2-yl)-2-methyl-N-propylpentan-3-amine
CID 63560615
1-butan-2-ylsulfanyl-3-phenyl-N-propylpropan-2-amine
CID 65136095
2-(2-fluorophenyl)-N-propylpentan-3-amine
CID 79308291

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-phenyl-N-propylpentan-3-amine?
The IUPAC name of 2-methyl-1-phenyl-N-propylpentan-3-amine (CID 63561010) is 2-methyl-1-phenyl-N-propylpentan-3-amine.
What is the SMILES notation for 2-methyl-1-phenyl-N-propylpentan-3-amine?
The canonical SMILES for 2-methyl-1-phenyl-N-propylpentan-3-amine is CCCNC(CC)C(C)Cc1ccccc1.
What is the InChIKey of 2-methyl-1-phenyl-N-propylpentan-3-amine?
The InChIKey is DASLMYQTIOMPDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-4-11-16-15(5-2)13(3)12-14-9-7-6-8-10-14/h6-10,13,15-16H,4-5,11-12H2,1-3H3.
What are the key properties of 2-methyl-1-phenyl-N-propylpentan-3-amine?
2-methyl-1-phenyl-N-propylpentan-3-amine has a molecular weight of 219.37 g/mol, XLogP of 3.64, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-phenyl-N-propylpentan-3-amine is sourced from PubChem (CID 63561010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).