N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine

C17H20N2 — CID 60894294

IUPACN-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESc1cncc(CCNC2CCCc3ccccc32)c1
InChIInChI=1S/C17H20N2/c1-2-8-16-15(6-1)7-3-9-17(16)19-12-10-14-5-4-11-18-13-14/h1-2,4-6,8,11,13,17,19H,3,7,9-10,12H2
InChIKeyQKDSCYURDADMGY-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.29
Rot. Bonds4

About N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine

N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 60894294) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID60894294
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC NameN-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESc1cncc(CCNC2CCCc3ccccc32)c1
InChIInChI=1S/C17H20N2/c1-2-8-16-15(6-1)7-3-9-17(16)19-12-10-14-5-4-11-18-13-14/h1-2,4-6,8,11,13,17,19H,3,7,9-10,12H2
InChIKeyQKDSCYURDADMGY-UHFFFAOYSA-N
XLogP3.29
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-pyridin-3-ylethyl)-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 62842143
N-(4-phenylbutyl)-1,2,3,4-tetrahydronaphthalen-1-amine;dihydrochloride
CID 19773300
N-(pyridin-4-ylmethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 3755839
N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine
CID 60888348
N-(2-pyridin-2-ylethyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 43193645
3-(2-pyridin-3-ylethylamino)piperidin-2-one
CID 63264736
3-(2-pyridin-3-ylethylamino)azepan-2-one
CID 60914794
(1S)-N-[(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 52501408
N-methyl-N-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 134793387
N-[(1R)-1-pyridin-3-ylethyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 81406890
N-[2-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]ethyl]pyridine-3-sulfonamide
CID 124514745
3-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propanoic acid
CID 43087276

Frequently Asked Questions

What is the IUPAC name of N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine (CID 60894294) is N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine is c1cncc(CCNC2CCCc3ccccc32)c1.
What is the InChIKey of N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is QKDSCYURDADMGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-2-8-16-15(6-1)7-3-9-17(16)19-12-10-14-5-4-11-18-13-14/h1-2,4-6,8,11,13,17,19H,3,7,9-10,12H2.
What are the key properties of N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine?
N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 252.36 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyridin-3-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 60894294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).