2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine

C14H21NO — CID 83837271

IUPAC2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine
SMILESCCC(CN)(OC)c1ccc2c(c1)CCC2
InChIInChI=1S/C14H21NO/c1-3-14(10-15,16-2)13-8-7-11-5-4-6-12(11)9-13/h7-9H,3-6,10,15H2,1-2H3
InChIKeyJNVXDUFHWUSHSR-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.39
Rot. Bonds4

About 2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine

2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine (PubChem CID 83837271) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine
PubChem CID83837271
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine
SMILESCCC(CN)(OC)c1ccc2c(c1)CCC2
InChIInChI=1S/C14H21NO/c1-3-14(10-15,16-2)13-8-7-11-5-4-6-12(11)9-13/h7-9H,3-6,10,15H2,1-2H3
InChIKeyJNVXDUFHWUSHSR-UHFFFAOYSA-N
XLogP2.39
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5,6,7,8-tetrahydronaphthalen-2-yl)propane-1,2-diamine
CID 3052971
5-tert-butyl-2,3-dihydro-1H-indene
CID 15271758
2-(2,3-dihydro-1H-inden-5-ylmethoxy)-2-ethylbutan-1-amine
CID 65050910
1-(2,3-dihydro-1H-inden-5-yl)-3-ethyl-3-methoxypentan-2-amine
CID 116760450
2-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)pent-4-en-1-amine
CID 117049338
ethane;formamide;5-(2-methylpentan-2-yl)-2,3-dihydro-1H-indene
CID 144532564
3-tert-butylbicyclo[4.2.0]octa-1(6),2,4-triene
CID 15438926
3,3-difluoro-3-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-amine
CID 116838499
N-[3-(aminomethyl)pentan-3-yl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 61124769
2-(2,3-dihydro-1H-inden-5-yl)-N-(hydrazinylmethyl)-2-methylpropan-1-amine
CID 115261409
2-(2,3-dihydro-1H-inden-5-yl)heptan-2-ol
CID 114194197
3-(2,3-dihydro-1H-inden-5-yl)-N-ethyl-3-methylbutan-1-amine
CID 79830298

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine (CID 83837271) is 2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine is CCC(CN)(OC)c1ccc2c(c1)CCC2.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine?
The InChIKey is JNVXDUFHWUSHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-3-14(10-15,16-2)13-8-7-11-5-4-6-12(11)9-13/h7-9H,3-6,10,15H2,1-2H3.
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine?
2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yl)-2-methoxybutan-1-amine is sourced from PubChem (CID 83837271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).