N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine

C18H29N — CID 107448510

IUPACN-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine
SMILESCC(Cc1ccccc1)NC1CCCC(C(C)C)C1
InChIInChI=1S/C18H29N/c1-14(2)17-10-7-11-18(13-17)19-15(3)12-16-8-5-4-6-9-16/h4-6,8-9,14-15,17-19H,7,10-13H2,1-3H3
InChIKeyNFZZNFSFORZPIB-UHFFFAOYSA-N
MW259.44 g/mol
LogP4.42
Rot. Bonds5

About N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine

N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine (PubChem CID 107448510) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine
PubChem CID107448510
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC NameN-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine
SMILESCC(Cc1ccccc1)NC1CCCC(C(C)C)C1
InChIInChI=1S/C18H29N/c1-14(2)17-10-7-11-18(13-17)19-15(3)12-16-8-5-4-6-9-16/h4-6,8-9,14-15,17-19H,7,10-13H2,1-3H3
InChIKeyNFZZNFSFORZPIB-UHFFFAOYSA-N
XLogP4.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(4-fluorophenyl)propan-2-yl]-4-propan-2-ylcycloheptan-1-amine
CID 65091426
N-(1-phenylpropan-2-yl)spiro[4.5]decan-8-amine
CID 114817644
4-[2-(cyclobutylamino)propyl]phenol
CID 115494316
N-pentan-2-yl-3-propan-2-ylcyclohexan-1-amine
CID 107447751
N-(1-methylsulfanylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine
CID 107448780
N-[1-(4-chlorophenyl)propan-2-yl]-4-propan-2-ylcyclohexan-1-amine
CID 63428446
3-[1-(3-fluorophenyl)propan-2-ylamino]cyclohexan-1-ol
CID 113260471
1-N-[1-(3-chlorophenyl)propan-2-yl]cyclohexane-1,3-diamine
CID 79459034
1-[4-[[(2R)-1-phenylpropan-2-yl]amino]piperidin-1-yl]ethanone
CID 94923523
N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine
CID 82262639
N-pent-4-yn-2-yl-3-propan-2-ylcyclohexan-1-amine
CID 107448786
N-[1-(4-chlorophenyl)propan-2-yl]cycloheptanamine
CID 43677619

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine?
The IUPAC name of N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine (CID 107448510) is N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine.
What is the SMILES notation for N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine?
The canonical SMILES for N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine is CC(Cc1ccccc1)NC1CCCC(C(C)C)C1.
What is the InChIKey of N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine?
The InChIKey is NFZZNFSFORZPIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-14(2)17-10-7-11-18(13-17)19-15(3)12-16-8-5-4-6-9-16/h4-6,8-9,14-15,17-19H,7,10-13H2,1-3H3.
What are the key properties of N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine?
N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine has a molecular weight of 259.44 g/mol, XLogP of 4.42, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpropan-2-yl)-3-propan-2-ylcyclohexan-1-amine is sourced from PubChem (CID 107448510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).