4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol

C16H24N2O — CID 79136036

IUPAC4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol
SMILESNCC1(C2(O)CCNCC2)CCc2ccccc2C1
InChIInChI=1S/C16H24N2O/c17-12-15(16(19)7-9-18-10-8-16)6-5-13-3-1-2-4-14(13)11-15/h1-4,18-19H,5-12,17H2
InChIKeyHTTNPBFATSBRGV-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.23
Rot. Bonds2

About 4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol

4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol (PubChem CID 79136036) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol.

Molecular Properties

Compound Name4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol
PubChem CID79136036
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol
SMILESNCC1(C2(O)CCNCC2)CCc2ccccc2C1
InChIInChI=1S/C16H24N2O/c17-12-15(16(19)7-9-18-10-8-16)6-5-13-3-1-2-4-14(13)11-15/h1-4,18-19H,5-12,17H2
InChIKeyHTTNPBFATSBRGV-UHFFFAOYSA-N
XLogP1.23
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]oxan-4-ol
CID 79135402
1-[2-(aminomethyl)-1,3-dihydroinden-2-yl]-4,4-dimethylcyclohexan-1-ol
CID 79123441
3-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]-1,5-dimethylpyrrolidin-3-ol
CID 81468062
2-[1-(aminomethyl)cycloheptyl]-1,3-dihydroinden-2-ol
CID 79126623
1-[2-(aminomethyl)-1,3-dihydroinden-2-yl]-4-propan-2-ylcyclohexan-1-ol
CID 79125708
3-[2-(aminomethyl)-1,3-dihydroinden-2-yl]oxolan-3-ol
CID 79135407
[2-(2-methylpropyl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine
CID 65408100
1-[2-(aminomethyl)-1,3-dihydroinden-2-yl]-4-propylcyclohexan-1-ol
CID 79124761
4-[1-(aminomethyl)cyclopentyl]azepan-4-ol
CID 103983091
1-[2-(aminomethyl)-1,3-dihydroinden-2-yl]-3-cyclopropylcyclohexan-1-ol
CID 79125376
(2-nonyl-3,4-dihydro-1H-naphthalen-2-yl)methanamine
CID 65408872
4-[3-(aminomethyl)-2,4-dihydrochromen-3-yl]-3-methylpiperidin-4-ol
CID 114502234

Frequently Asked Questions

What is the IUPAC name of 4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol?
The IUPAC name of 4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol (CID 79136036) is 4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol.
What is the SMILES notation for 4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol?
The canonical SMILES for 4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol is NCC1(C2(O)CCNCC2)CCc2ccccc2C1.
What is the InChIKey of 4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol?
The InChIKey is HTTNPBFATSBRGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c17-12-15(16(19)7-9-18-10-8-16)6-5-13-3-1-2-4-14(13)11-15/h1-4,18-19H,5-12,17H2.
What are the key properties of 4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol?
4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol has a molecular weight of 260.38 g/mol, XLogP of 1.23, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-yl]piperidin-4-ol is sourced from PubChem (CID 79136036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).