N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine

C17H29N3O — CID 106632503

IUPACN-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine
SMILESCCN(Cc1ncc(C)c(OC)c1C)CC1CCCCN1
InChIInChI=1S/C17H29N3O/c1-5-20(11-15-8-6-7-9-18-15)12-16-14(3)17(21-4)13(2)10-19-16/h10,15,18H,5-9,11-12H2,1-4H3
InChIKeyGNZWSMUDYDUTMB-UHFFFAOYSA-N
MW291.44 g/mol
LogP2.67
Rot. Bonds6

About N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine

N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine (PubChem CID 106632503) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine
PubChem CID106632503
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC NameN-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine
SMILESCCN(Cc1ncc(C)c(OC)c1C)CC1CCCCN1
InChIInChI=1S/C17H29N3O/c1-5-20(11-15-8-6-7-9-18-15)12-16-14(3)17(21-4)13(2)10-19-16/h10,15,18H,5-9,11-12H2,1-4H3
InChIKeyGNZWSMUDYDUTMB-UHFFFAOYSA-N
XLogP2.67
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-1-pyrrolidin-2-ylethanone
CID 116547474
N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]ethanamine
CID 6999827
N-(2-bromoethyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentanamine
CID 80672726
N-(azepan-2-ylmethyl)-N-ethylethanamine
CID 4715268
N-[(2,5-dimethylphenyl)methyl]-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106603290
4-N-ethyl-4-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexane-1,4-diamine
CID 79112586
N-[(2-fluoro-3-methoxyphenyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine
CID 106632656
N-benzyl-N-(piperidin-2-ylmethyl)ethanamine;dihydrochloride
CID 56831759
2-[3-bromo-2-(bromomethyl)-2-cyclopentylpropyl]-4-methoxy-3,5-dimethylpyridine
CID 115927255
N-[(5-bromo-2-methoxyphenyl)methyl]-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106603284
N-[(4-chloro-6-methylpyrimidin-2-yl)methyl]-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106615398
N-[(5-fluoro-2-methoxyphenyl)methyl]-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106614885

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine?
The IUPAC name of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine (CID 106632503) is N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine.
What is the SMILES notation for N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine?
The canonical SMILES for N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine is CCN(Cc1ncc(C)c(OC)c1C)CC1CCCCN1.
What is the InChIKey of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine?
The InChIKey is GNZWSMUDYDUTMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-5-20(11-15-8-6-7-9-18-15)12-16-14(3)17(21-4)13(2)10-19-16/h10,15,18H,5-9,11-12H2,1-4H3.
What are the key properties of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine?
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine has a molecular weight of 291.44 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine is sourced from PubChem (CID 106632503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).