N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine

C16H25N — CID 55175096

IUPACN-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
SMILESCCNC(C(C)C)C1CCCc2ccccc21
InChIInChI=1S/C16H25N/c1-4-17-16(12(2)3)15-11-7-9-13-8-5-6-10-14(13)15/h5-6,8,10,12,15-17H,4,7,9,11H2,1-3H3
InChIKeySOSOLUIFCOUWTO-UHFFFAOYSA-N
MW231.38 g/mol
LogP3.74
Rot. Bonds4

About N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine

N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine (PubChem CID 55175096) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
PubChem CID55175096
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC NameN-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
SMILESCCNC(C(C)C)C1CCCc2ccccc21
InChIInChI=1S/C16H25N/c1-4-17-16(12(2)3)15-11-7-9-13-8-5-6-10-14(13)15/h5-6,8,10,12,15-17H,4,7,9,11H2,1-3H3
InChIKeySOSOLUIFCOUWTO-UHFFFAOYSA-N
XLogP3.74
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclopentyl-N-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 63418635
N-[(4-methylcyclohexyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]ethanamine
CID 64774222
N-[(4-bromophenyl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]ethanamine
CID 63509295
ethane;1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 144539733
2,2-dimethyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
CID 55188342
N-ethyl-2-propoxy-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 79575553
1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 63247593
N-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)-2-(1,3-thiazol-2-yl)ethanamine
CID 79824813
N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-amine
CID 55188345
N-[cyclohexyl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]propan-1-amine
CID 63418251
1-(2,3-dihydro-1H-inden-2-yl)-N-ethyl-2-methylpropan-1-amine
CID 65411320
N-ethyl-2-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 82868525

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
The IUPAC name of N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine (CID 55175096) is N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
The canonical SMILES for N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine is CCNC(C(C)C)C1CCCc2ccccc21.
What is the InChIKey of N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
The InChIKey is SOSOLUIFCOUWTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-4-17-16(12(2)3)15-11-7-9-13-8-5-6-10-14(13)15/h5-6,8,10,12,15-17H,4,7,9,11H2,1-3H3.
What are the key properties of N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine has a molecular weight of 231.38 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine is sourced from PubChem (CID 55175096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).