N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine

C17H26N2 — CID 62655412

IUPACN-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
SMILESCN1CCCC(CNc2cccc3c2CCCC3)C1
InChIInChI=1S/C17H26N2/c1-19-11-5-6-14(13-19)12-18-17-10-4-8-15-7-2-3-9-16(15)17/h4,8,10,14,18H,2-3,5-7,9,11-13H2,1H3
InChIKeyMZMYYFGZHDAIRU-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.32
Rot. Bonds3

About N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine

N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine (PubChem CID 62655412) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
PubChem CID62655412
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC NameN-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
SMILESCN1CCCC(CNc2cccc3c2CCCC3)C1
InChIInChI=1S/C17H26N2/c1-19-11-5-6-14(13-19)12-18-17-10-4-8-15-7-2-3-9-16(15)17/h4,8,10,14,18H,2-3,5-7,9,11-13H2,1H3
InChIKeyMZMYYFGZHDAIRU-UHFFFAOYSA-N
XLogP3.32
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dimethyl-N-[(1-methylpiperidin-3-yl)methyl]aniline
CID 62655606
1-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)azepan-4-amine
CID 65071434
2-fluoro-N-[(1-methylpiperidin-3-yl)methyl]aniline
CID 62655960
3-bromo-2-methyl-N-[(1-methylpiperidin-3-yl)methyl]aniline
CID 107629665
N-[1-(1-methylpiperidin-3-yl)ethyl]-5,6,7,8-tetrahydronaphthalen-1-amine
CID 43307588
N-(cyclohex-3-en-1-ylmethyl)-5,6,7,8-tetrahydronaphthalen-1-amine
CID 43102283
N-(oxolan-3-ylmethyl)-5,6,7,8-tetrahydronaphthalen-1-amine
CID 43192228
1-[2-[(1-methylpiperidin-3-yl)methylamino]phenyl]ethanol
CID 62658137
2-fluoro-6-[(1-methylpiperidin-3-yl)methylamino]benzoic acid
CID 79522921
N,2-dimethyl-3-[(1-methylpiperidin-3-yl)methylamino]benzamide
CID 62658463
N-[(1-methylpiperidin-3-yl)methyl]-2-morpholin-4-ylaniline
CID 62659401
3-methyl-2-[(1-methylpiperidin-3-yl)methylamino]benzonitrile
CID 107106742

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine?
The IUPAC name of N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine (CID 62655412) is N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine is CN1CCCC(CNc2cccc3c2CCCC3)C1.
What is the InChIKey of N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine?
The InChIKey is MZMYYFGZHDAIRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-19-11-5-6-14(13-19)12-18-17-10-4-8-15-7-2-3-9-16(15)17/h4,8,10,14,18H,2-3,5-7,9,11-13H2,1H3.
What are the key properties of N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine?
N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine has a molecular weight of 258.41 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 62655412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).