N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine

C17H27N — CID 82262639

IUPACN-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine
SMILESCC(Cc1ccc(C(C)C)cc1)NC1CCCC1
InChIInChI=1S/C17H27N/c1-13(2)16-10-8-15(9-11-16)12-14(3)18-17-6-4-5-7-17/h8-11,13-14,17-18H,4-7,12H2,1-3H3
InChIKeyWNRIOWNYPAJLAH-UHFFFAOYSA-N
MW245.41 g/mol
LogP4.27
Rot. Bonds5

About N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine

N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine (PubChem CID 82262639) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine.

Molecular Properties

Compound NameN-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine
PubChem CID82262639
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC NameN-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine
SMILESCC(Cc1ccc(C(C)C)cc1)NC1CCCC1
InChIInChI=1S/C17H27N/c1-13(2)16-10-8-15(9-11-16)12-14(3)18-17-6-4-5-7-17/h8-11,13-14,17-18H,4-7,12H2,1-3H3
InChIKeyWNRIOWNYPAJLAH-UHFFFAOYSA-N
XLogP4.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopropanamine
CID 82262582
N-[1-(4-butan-2-ylphenyl)propan-2-yl]cyclopentanamine
CID 82262683
N-[1-(4-chlorophenyl)propan-2-yl]cycloheptanamine
CID 43677619
N-[1-(4-fluorophenyl)propan-2-yl]cyclooctanamine
CID 63464519
4-[2-(cyclobutylamino)propyl]phenol
CID 115494316
N-[1-(4-methoxyphenyl)propan-2-yl]cycloheptanamine
CID 2846450
1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 63413394
N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine
CID 43694776
N-[1-(4-chlorophenyl)propan-2-yl]-4-propan-2-ylcyclohexan-1-amine
CID 63428446
N-[1-(4-chlorophenyl)propan-2-yl]-4-methylcyclohexan-1-amine
CID 43677618
N-[1-(4-fluorophenyl)propan-2-yl]-4-propan-2-ylcycloheptan-1-amine
CID 65091426
N-[(4-propan-2-ylphenyl)methyl]cycloheptanamine;hydrochloride
CID 17331879

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine?
The IUPAC name of N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine (CID 82262639) is N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine.
What is the SMILES notation for N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine?
The canonical SMILES for N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine is CC(Cc1ccc(C(C)C)cc1)NC1CCCC1.
What is the InChIKey of N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine?
The InChIKey is WNRIOWNYPAJLAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N/c1-13(2)16-10-8-15(9-11-16)12-14(3)18-17-6-4-5-7-17/h8-11,13-14,17-18H,4-7,12H2,1-3H3.
What are the key properties of N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine?
N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine has a molecular weight of 245.41 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine is sourced from PubChem (CID 82262639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).