1-phenyl-N-propylpentan-2-amine

C14H23N — CID 10262369

IUPAC1-phenyl-N-propylpentan-2-amine
SMILESCCCNC(CCC)Cc1ccccc1
InChIInChI=1S/C14H23N/c1-3-8-14(15-11-4-2)12-13-9-6-5-7-10-13/h5-7,9-10,14-15H,3-4,8,11-12H2,1-2H3
InChIKeyPBENSVGEGPJNFJ-UHFFFAOYSA-N
MW205.35 g/mol
LogP3.40
Rot. Bonds7

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

1-phenyl-N-propylpentan-2-amine (PubChem CID 10262369) has the molecular formula C14H23N and a molecular weight of 205.35 g/mol. Its IUPAC name is 1-phenyl-N-propylpentan-2-amine.

Molecular Properties

Compound Name1-phenyl-N-propylpentan-2-amine
PubChem CID10262369
Molecular FormulaC14H23N
Molecular Weight205.35 g/mol
Exact Mass205.18
IUPAC Name1-phenyl-N-propylpentan-2-amine
SMILESCCCNC(CCC)Cc1ccccc1
InChIInChI=1S/C14H23N/c1-3-8-14(15-11-4-2)12-13-9-6-5-7-10-13/h5-7,9-10,14-15H,3-4,8,11-12H2,1-2H3
InChIKeyPBENSVGEGPJNFJ-UHFFFAOYSA-N
XLogP3.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.35
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-propylpentan-2-amine?
The IUPAC name of 1-phenyl-N-propylpentan-2-amine (CID 10262369) is 1-phenyl-N-propylpentan-2-amine.
What is the SMILES notation for 1-phenyl-N-propylpentan-2-amine?
The canonical SMILES for 1-phenyl-N-propylpentan-2-amine is CCCNC(CCC)Cc1ccccc1.
What is the InChIKey of 1-phenyl-N-propylpentan-2-amine?
The InChIKey is PBENSVGEGPJNFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-3-8-14(15-11-4-2)12-13-9-6-5-7-10-13/h5-7,9-10,14-15H,3-4,8,11-12H2,1-2H3.
What are the key properties of 1-phenyl-N-propylpentan-2-amine?
1-phenyl-N-propylpentan-2-amine has a molecular weight of 205.35 g/mol, XLogP of 3.40, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-propylpentan-2-amine is sourced from PubChem (CID 10262369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).