2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine

C17H29N3O — CID 62297544

IUPAC2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine
SMILESCC(C)(C)NCc1cc(OCCN2CCCCC2)ccn1
InChIInChI=1S/C17H29N3O/c1-17(2,3)19-14-15-13-16(7-8-18-15)21-12-11-20-9-5-4-6-10-20/h7-8,13,19H,4-6,9-12,14H2,1-3H3
InChIKeyKPJPXKHYPPUNMY-UHFFFAOYSA-N
MW291.44 g/mol
LogP2.83
Rot. Bonds6

About 2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine

2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine (PubChem CID 62297544) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is 2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine
PubChem CID62297544
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC Name2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine
SMILESCC(C)(C)NCc1cc(OCCN2CCCCC2)ccn1
InChIInChI=1S/C17H29N3O/c1-17(2,3)19-14-15-13-16(7-8-18-15)21-12-11-20-9-5-4-6-10-20/h7-8,13,19H,4-6,9-12,14H2,1-3H3
InChIKeyKPJPXKHYPPUNMY-UHFFFAOYSA-N
XLogP2.83
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 ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[[3-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]propan-2-amine
CID 62438277
2-chloro-4-(2-pyrrolidin-1-ylethoxy)pyridine
CID 63778456
(2R,3S)-3-amino-2-hydroxy-5-methyl-2-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]hexanoic acid
CID 118549763
1-[2-(3,4-dimethylphenoxy)ethyl]azepane
CID 82086608
1-[2-[4-(2-methylbutan-2-yl)phenoxy]ethyl]piperidine
CID 70865812
2-methyl-N-[[5-(2-piperidin-1-ylethoxy)-1,3,4-thiadiazol-2-yl]methyl]propan-2-amine
CID 80619924
2-methyl-N-[[4-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 62386548
1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
CID 803619
4-(3-pyrrolidin-1-ylpropoxy)pyridin-2-amine
CID 155587886
N-[[1-[2-(azepan-1-yl)ethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine
CID 62438721
1-[2-(4-methoxyphenoxy)ethyl]azepane
CID 888209
N-[[6-(azocan-1-ylmethyl)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 106905667

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine (CID 62297544) is 2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine is CC(C)(C)NCc1cc(OCCN2CCCCC2)ccn1.
What is the InChIKey of 2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine?
The InChIKey is KPJPXKHYPPUNMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-17(2,3)19-14-15-13-16(7-8-18-15)21-12-11-20-9-5-4-6-10-20/h7-8,13,19H,4-6,9-12,14H2,1-3H3.
What are the key properties of 2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine?
2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine has a molecular weight of 291.44 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[4-(2-piperidin-1-ylethoxy)-2-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 62297544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).