N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine

C17H26N2O — CID 79374703

IUPACN-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine
SMILESCCN(C1CCCNC1)C1CCc2ccc(OC)cc21
InChIInChI=1S/C17H26N2O/c1-3-19(14-5-4-10-18-12-14)17-9-7-13-6-8-15(20-2)11-16(13)17/h6,8,11,14,17-18H,3-5,7,9-10,12H2,1-2H3
InChIKeyOFBPAIBNVYZAPW-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.76
Rot. Bonds4

About N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine

N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine (PubChem CID 79374703) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine.

Molecular Properties

Compound NameN-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine
PubChem CID79374703
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine
SMILESCCN(C1CCCNC1)C1CCc2ccc(OC)cc21
InChIInChI=1S/C17H26N2O/c1-3-19(14-5-4-10-18-12-14)17-9-7-13-6-8-15(20-2)11-16(13)17/h6,8,11,14,17-18H,3-5,7,9-10,12H2,1-2H3
InChIKeyOFBPAIBNVYZAPW-UHFFFAOYSA-N
XLogP2.76
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methoxy-N-propyl-N-(pyrrolidin-2-ylmethyl)-2,3-dihydro-1H-inden-1-amine
CID 106604140
N-[(2-bromo-5-methoxyphenyl)methyl]-N-methylpiperidin-3-amine
CID 65327435
2-[cyclopropyl-(7-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetic acid
CID 79247936
N-ethyl-7-methoxy-N-(pyrrolidin-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 106603727
2-[ethyl-(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]acetic acid
CID 79367822
N'-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-N,N'-dimethylethane-1,2-diamine
CID 79374274
3-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrrolidine
CID 79368569
2-[ethyl-(7-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetic acid
CID 79248400
2-[ethyl(piperidin-3-yl)amino]-4-methoxybenzonitrile
CID 81304790
N-(4-methoxy-2-nitrophenyl)-N-propylpiperidin-3-amine
CID 63636836
2-N-(cyclobutylmethyl)-2-N-ethyl-7-methoxy-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 107398041
N-ethyl-N-[1-(3-methoxyphenyl)ethyl]piperidin-3-amine
CID 55250096

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine?
The IUPAC name of N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine (CID 79374703) is N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine.
What is the SMILES notation for N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine?
The canonical SMILES for N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine is CCN(C1CCCNC1)C1CCc2ccc(OC)cc21.
What is the InChIKey of N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine?
The InChIKey is OFBPAIBNVYZAPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-3-19(14-5-4-10-18-12-14)17-9-7-13-6-8-15(20-2)11-16(13)17/h6,8,11,14,17-18H,3-5,7,9-10,12H2,1-2H3.
What are the key properties of N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine?
N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine has a molecular weight of 274.41 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)piperidin-3-amine is sourced from PubChem (CID 79374703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).