2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol

C14H30N2O2 — CID 114210339

IUPAC2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol
SMILESCCN1CCC(C(C)NC(CO)CCOC)CC1
InChIInChI=1S/C14H30N2O2/c1-4-16-8-5-13(6-9-16)12(2)15-14(11-17)7-10-18-3/h12-15,17H,4-11H2,1-3H3
InChIKeyQZGZXXBPHBEFHR-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.09
Rot. Bonds8

About 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol

2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol (PubChem CID 114210339) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol.

Molecular Properties

Compound Name2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol
PubChem CID114210339
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol
SMILESCCN1CCC(C(C)NC(CO)CCOC)CC1
InChIInChI=1S/C14H30N2O2/c1-4-16-8-5-13(6-9-16)12(2)15-14(11-17)7-10-18-3/h12-15,17H,4-11H2,1-3H3
InChIKeyQZGZXXBPHBEFHR-UHFFFAOYSA-N
XLogP1.09
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxy-2-methylbutan-2-ol
CID 106249309
4-methoxy-N-[1-(1-methylpiperidin-4-yl)ethyl]butan-2-amine
CID 64604411
N-[1-(1-ethylpiperidin-4-yl)ethyl]octan-4-amine
CID 106023059
3-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylsulfanylbutan-1-ol
CID 106158702
3-methoxy-2-[1-(1-propylpiperidin-3-yl)ethylamino]propan-1-ol
CID 106186760
2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol
CID 103504030
1-(1-ethylpiperidin-4-yl)ethanol
CID 588327
methyl 2-[1-(1-ethylpiperidin-4-yl)ethylamino]acetate
CID 43307422
1-methoxy-N-[1-(1-propylpiperidin-4-yl)ethyl]propan-2-amine
CID 43307539
2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide
CID 106344149
N-[(1S)-1-cyclopentylethyl]-4-methoxybutan-2-amine
CID 81385535
2-[1-(1-propylpiperidin-4-yl)ethylamino]propan-1-ol
CID 43499437

Frequently Asked Questions

What is the IUPAC name of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol?
The IUPAC name of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol (CID 114210339) is 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol.
What is the SMILES notation for 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol?
The canonical SMILES for 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol is CCN1CCC(C(C)NC(CO)CCOC)CC1.
What is the InChIKey of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol?
The InChIKey is QZGZXXBPHBEFHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-4-16-8-5-13(6-9-16)12(2)15-14(11-17)7-10-18-3/h12-15,17H,4-11H2,1-3H3.
What are the key properties of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol?
2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol has a molecular weight of 258.41 g/mol, XLogP of 1.09, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol is sourced from PubChem (CID 114210339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).