[2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol

C15H27N3O — CID 102996028

IUPAC[2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol
SMILESCCN(CC)CCCN(CC)c1cc(CO)ccn1
InChIInChI=1S/C15H27N3O/c1-4-17(5-2)10-7-11-18(6-3)15-12-14(13-19)8-9-16-15/h8-9,12,19H,4-7,10-11,13H2,1-3H3
InChIKeyMWIFMCILNFHLAD-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.13
Rot. Bonds9

About [2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol

[2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol (PubChem CID 102996028) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is [2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol
PubChem CID102996028
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name[2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol
SMILESCCN(CC)CCCN(CC)c1cc(CO)ccn1
InChIInChI=1S/C15H27N3O/c1-4-17(5-2)10-7-11-18(6-3)15-12-14(13-19)8-9-16-15/h8-9,12,19H,4-7,10-11,13H2,1-3H3
InChIKeyMWIFMCILNFHLAD-UHFFFAOYSA-N
XLogP2.13
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]ethanol
CID 102994915
[2-[3-(diethylamino)propyl-ethylamino]-6-methyl-4-pyridinyl]methanol
CID 102996011
2-[3-(diethylamino)propyl-ethylamino]pyridine-4-carbonitrile
CID 102993231
[2-[cyclopropylmethyl(ethyl)amino]-4-pyridinyl]methanol
CID 63955026
[2-[2-methoxyethyl(3-methoxypropyl)amino]-4-pyridinyl]methanol
CID 54989948
[2-[butyl(methyl)amino]-4-pyridinyl]methanol
CID 61254738
[2-(dimethylamino)-4-pyridinyl]methanol
CID 22625066
N'-[4-(chloromethyl)-6-ethyl-2-pyridinyl]-N,N,N'-triethylpropane-1,3-diamine
CID 102996063
[2-[cyclopropylmethyl(propyl)amino]-4-pyridinyl]methanol
CID 61445364
6-[3-(diethylamino)propyl-ethylamino]pyridazine-3-carboxylic acid
CID 102994003
[2-[2-(dimethylamino)ethyl-methylamino]-4-pyridinyl]methanol
CID 63698708
N'-ethyl-N,N-dimethyl-N'-[4-[(2-methylpropylamino)methyl]-2-pyridinyl]propane-1,3-diamine
CID 102997386

Frequently Asked Questions

What is the IUPAC name of [2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol?
The IUPAC name of [2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol (CID 102996028) is [2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol.
What is the SMILES notation for [2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol?
The canonical SMILES for [2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol is CCN(CC)CCCN(CC)c1cc(CO)ccn1.
What is the InChIKey of [2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol?
The InChIKey is MWIFMCILNFHLAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-4-17(5-2)10-7-11-18(6-3)15-12-14(13-19)8-9-16-15/h8-9,12,19H,4-7,10-11,13H2,1-3H3.
What are the key properties of [2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol?
[2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol has a molecular weight of 265.40 g/mol, XLogP of 2.13, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[3-(diethylamino)propyl-ethylamino]-4-pyridinyl]methanol is sourced from PubChem (CID 102996028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).