2-(2,4-dichlorophenyl)-2-propylpentan-1-amine

C14H21Cl2N — CID 63515518

IUPAC2-(2,4-dichlorophenyl)-2-propylpentan-1-amine
SMILESCCCC(CN)(CCC)c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H21Cl2N/c1-3-7-14(10-17,8-4-2)12-6-5-11(15)9-13(12)16/h5-6,9H,3-4,7-8,10,17H2,1-2H3
InChIKeyYDNOUTIMNDKZIE-UHFFFAOYSA-N
MW274.24 g/mol
LogP4.79
Rot. Bonds6

About 2-(2,4-dichlorophenyl)-2-propylpentan-1-amine

2-(2,4-dichlorophenyl)-2-propylpentan-1-amine (PubChem CID 63515518) has the molecular formula C14H21Cl2N and a molecular weight of 274.24 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-2-propylpentan-1-amine.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-2-propylpentan-1-amine
PubChem CID63515518
Molecular FormulaC14H21Cl2N
Molecular Weight274.24 g/mol
Exact Mass273.11
IUPAC Name2-(2,4-dichlorophenyl)-2-propylpentan-1-amine
SMILESCCCC(CN)(CCC)c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H21Cl2N/c1-3-7-14(10-17,8-4-2)12-6-5-11(15)9-13(12)16/h5-6,9H,3-4,7-8,10,17H2,1-2H3
InChIKeyYDNOUTIMNDKZIE-UHFFFAOYSA-N
XLogP4.79
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.24
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-(2,4-dichlorophenyl)-2-fluoropropan-1-amine
CID 124567259
2-(2,4-dichlorophenyl)-2-methoxypentan-1-ol
CID 23039737
3-(2,4-dichlorophenyl)pentan-3-amine
CID 60987757
2-(2,4-dichlorophenyl)-2-ethoxypentan-1-ol
CID 23039690
2-(2-chloro-6-fluorophenyl)-2-propylpentan-1-amine
CID 63515341
2-(4-chlorophenyl)-4-methyl-2-propylpentan-1-amine
CID 82017487
2-(2,4-dichlorophenyl)-2-methylpent-4-en-1-amine
CID 117049327
[2-(2,4-dichlorophenyl)-2-methoxypentyl] methanesulfonate
CID 23039678
3-(2,4-dichlorophenyl)-2-methylheptan-3-ol
CID 139474082
5-[2-(2,4-dichlorophenyl)pentan-2-yl]-1H-pyrazol-3-amine;ethane
CID 142202790
2-(2,4-dichlorophenyl)propan-2-ol
CID 67803482
2-(2,4-dichlorophenyl)-1,1,1-trifluorobutan-2-ol
CID 83957607

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-2-propylpentan-1-amine?
The IUPAC name of 2-(2,4-dichlorophenyl)-2-propylpentan-1-amine (CID 63515518) is 2-(2,4-dichlorophenyl)-2-propylpentan-1-amine.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-2-propylpentan-1-amine?
The canonical SMILES for 2-(2,4-dichlorophenyl)-2-propylpentan-1-amine is CCCC(CN)(CCC)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenyl)-2-propylpentan-1-amine?
The InChIKey is YDNOUTIMNDKZIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21Cl2N/c1-3-7-14(10-17,8-4-2)12-6-5-11(15)9-13(12)16/h5-6,9H,3-4,7-8,10,17H2,1-2H3.
What are the key properties of 2-(2,4-dichlorophenyl)-2-propylpentan-1-amine?
2-(2,4-dichlorophenyl)-2-propylpentan-1-amine has a molecular weight of 274.24 g/mol, XLogP of 4.79, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-2-propylpentan-1-amine is sourced from PubChem (CID 63515518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).