(2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol

C14H22N2O3 — CID 116754132

IUPAC(2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol
SMILESCCOC1(C(O)c2c(C)ccnc2N)CCOCC1
InChIInChI=1S/C14H22N2O3/c1-3-19-14(5-8-18-9-6-14)12(17)11-10(2)4-7-16-13(11)15/h4,7,12,17H,3,5-6,8-9H2,1-2H3,(H2,15,16)
InChIKeyRXRAMGKQGZYPGP-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.59
Rot. Bonds4

About (2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol

(2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol (PubChem CID 116754132) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is (2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol.

Molecular Properties

Compound Name(2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol
PubChem CID116754132
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name(2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol
SMILESCCOC1(C(O)c2c(C)ccnc2N)CCOCC1
InChIInChI=1S/C14H22N2O3/c1-3-19-14(5-8-18-9-6-14)12(17)11-10(2)4-7-16-13(11)15/h4,7,12,17H,3,5-6,8-9H2,1-2H3,(H2,15,16)
InChIKeyRXRAMGKQGZYPGP-UHFFFAOYSA-N
XLogP1.59
TPSA77.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(4-methoxyoxan-4-yl)-(propylamino)methyl]-4-methylpyridin-2-amine
CID 116765092
3-[(1-ethoxycyclohexyl)-hydrazinylmethyl]-4-methylpyridin-2-amine
CID 105276403
(3,4-dichlorophenyl)-(4-ethoxyoxan-4-yl)methanol
CID 116754164
4-[2-amino-2-(4-ethoxyoxan-4-yl)ethyl]pyridin-2-amine
CID 116765534
(4-tert-butylphenyl)-(4-ethoxyoxan-4-yl)methanol
CID 116754252
3-[2-(4-ethoxyoxan-4-yl)-2-(ethylamino)ethyl]pyridin-2-amine
CID 116765898
(4-ethoxyoxan-4-yl)-naphthalen-1-ylmethanol
CID 116754309
(1-ethoxycyclopentyl)-(4-methyl-3-pyridinyl)methanol
CID 116753217
(4-ethoxyoxan-4-yl)-[3-(trifluoromethyl)phenyl]methanol
CID 116754328
2-(3,4-dichlorophenyl)-1-(4-ethoxyoxan-4-yl)ethanamine
CID 116765394
(1-ethoxy-4,4-dimethylcyclohexyl)-(4-methyl-3-pyridinyl)methanol
CID 116755515
(4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol
CID 114519169

Frequently Asked Questions

What is the IUPAC name of (2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol?
The IUPAC name of (2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol (CID 116754132) is (2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol.
What is the SMILES notation for (2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol?
The canonical SMILES for (2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol is CCOC1(C(O)c2c(C)ccnc2N)CCOCC1.
What is the InChIKey of (2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol?
The InChIKey is RXRAMGKQGZYPGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-3-19-14(5-8-18-9-6-14)12(17)11-10(2)4-7-16-13(11)15/h4,7,12,17H,3,5-6,8-9H2,1-2H3,(H2,15,16).
What are the key properties of (2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol?
(2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol has a molecular weight of 266.34 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-4-methyl-3-pyridinyl)-(4-ethoxyoxan-4-yl)methanol is sourced from PubChem (CID 116754132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).