1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol

C16H26N2O — CID 60898879

IUPAC1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol
SMILESCCN(CC)CC(O)CNc1ccc2c(c1)CCC2
InChIInChI=1S/C16H26N2O/c1-3-18(4-2)12-16(19)11-17-15-9-8-13-6-5-7-14(13)10-15/h8-10,16-17,19H,3-7,11-12H2,1-2H3
InChIKeyFQSIDAXIFMLNGA-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.29
Rot. Bonds7

About 1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol

1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol (PubChem CID 60898879) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol.

Molecular Properties

Compound Name1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol
PubChem CID60898879
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol
SMILESCCN(CC)CC(O)CNc1ccc2c(c1)CCC2
InChIInChI=1S/C16H26N2O/c1-3-18(4-2)12-16(19)11-17-15-9-8-13-6-5-7-14(13)10-15/h8-10,16-17,19H,3-7,11-12H2,1-2H3
InChIKeyFQSIDAXIFMLNGA-UHFFFAOYSA-N
XLogP2.29
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(5,6,7,8-tetrahydronaphthalen-2-ylamino)propane-1,2-diol
CID 115121860
1-(4-bromo-3-methylanilino)-3-(diethylamino)propan-2-ol
CID 60897509
1-(4-bromoanilino)-3-(diethylamino)propan-2-ol
CID 60897805
1-(diethylamino)-3-(4-ethylanilino)propan-2-ol
CID 60900874
1-(3-chloro-4-fluoroanilino)-3-(diethylamino)propan-2-ol
CID 83108692
1-(3-bromoanilino)-3-(diethylamino)propan-2-ol
CID 60898520
1-(diethylamino)-3-(3-fluoroanilino)propan-2-ol
CID 60897193
1-cyclopentyloxy-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol
CID 60898492
2-[(2,3-dihydro-1H-inden-5-ylamino)methyl]-3-methylbutan-1-ol
CID 115251818
1-(diethylamino)-3-(3,4,5-trifluoroanilino)propan-2-ol
CID 62810463
3-(2,3-dihydro-1H-inden-5-ylamino)-2-methylpropanamide
CID 43312074
1-(2,3-dihydro-1H-inden-5-ylamino)propan-2-one
CID 115234414

Frequently Asked Questions

What is the IUPAC name of 1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol?
The IUPAC name of 1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol (CID 60898879) is 1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol.
What is the SMILES notation for 1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol?
The canonical SMILES for 1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol is CCN(CC)CC(O)CNc1ccc2c(c1)CCC2.
What is the InChIKey of 1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol?
The InChIKey is FQSIDAXIFMLNGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-18(4-2)12-16(19)11-17-15-9-8-13-6-5-7-14(13)10-15/h8-10,16-17,19H,3-7,11-12H2,1-2H3.
What are the key properties of 1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol?
1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol has a molecular weight of 262.40 g/mol, XLogP of 2.29, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(diethylamino)-3-(2,3-dihydro-1H-inden-5-ylamino)propan-2-ol is sourced from PubChem (CID 60898879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).