N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine

C14H21N — CID 144873896

IUPACN-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine
SMILESCNc1ccc(C(C)C)c2c1CCCC2
InChIInChI=1S/C14H21N/c1-10(2)11-8-9-14(15-3)13-7-5-4-6-12(11)13/h8-10,15H,4-7H2,1-3H3
InChIKeyRNSCTRFNVBRWBJ-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.73
Rot. Bonds2

About N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine

N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine (PubChem CID 144873896) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine
PubChem CID144873896
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC NameN-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine
SMILESCNc1ccc(C(C)C)c2c1CCCC2
InChIInChI=1S/C14H21N/c1-10(2)11-8-9-14(15-3)13-7-5-4-6-12(11)13/h8-10,15H,4-7H2,1-3H3
InChIKeyRNSCTRFNVBRWBJ-UHFFFAOYSA-N
XLogP3.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine?
The IUPAC name of N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine (CID 144873896) is N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine is CNc1ccc(C(C)C)c2c1CCCC2.
What is the InChIKey of N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine?
The InChIKey is RNSCTRFNVBRWBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-10(2)11-8-9-14(15-3)13-7-5-4-6-12(11)13/h8-10,15H,4-7H2,1-3H3.
What are the key properties of N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine?
N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 144873896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).