N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine

C18H29NO — CID 143694828

IUPACN,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine
SMILESCc1ccc(OC(C)C)cc1C1CCC(N(C)C)CC1
InChIInChI=1S/C18H29NO/c1-13(2)20-17-11-6-14(3)18(12-17)15-7-9-16(10-8-15)19(4)5/h6,11-13,15-16H,7-10H2,1-5H3
InChIKeySOWJOSVBKHMBQE-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.37
Rot. Bonds4

About N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine

N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine (PubChem CID 143694828) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine
PubChem CID143694828
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC NameN,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine
SMILESCc1ccc(OC(C)C)cc1C1CCC(N(C)C)CC1
InChIInChI=1S/C18H29NO/c1-13(2)20-17-11-6-14(3)18(12-17)15-7-9-16(10-8-15)19(4)5/h6,11-13,15-16H,7-10H2,1-5H3
InChIKeySOWJOSVBKHMBQE-UHFFFAOYSA-N
XLogP4.37
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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3-propan-2-yloxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ol
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2-cyclopropyl-4-[(2-methylpropan-2-yl)oxy]-1-propan-2-ylbenzene
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CID 54865516
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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine?
The IUPAC name of N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine (CID 143694828) is N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine.
What is the SMILES notation for N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine?
The canonical SMILES for N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine is Cc1ccc(OC(C)C)cc1C1CCC(N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine?
The InChIKey is SOWJOSVBKHMBQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-13(2)20-17-11-6-14(3)18(12-17)15-7-9-16(10-8-15)19(4)5/h6,11-13,15-16H,7-10H2,1-5H3.
What are the key properties of N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine?
N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine has a molecular weight of 275.44 g/mol, XLogP of 4.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(2-methyl-5-propan-2-yloxyphenyl)cyclohexan-1-amine is sourced from PubChem (CID 143694828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).