1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine

C16H26N2O — CID 62724590

IUPAC1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine
SMILESCNCC1(Cc2ncc(C)c(OC)c2C)CCCC1
InChIInChI=1S/C16H26N2O/c1-12-10-18-14(13(2)15(12)19-4)9-16(11-17-3)7-5-6-8-16/h10,17H,5-9,11H2,1-4H3
InChIKeyMXQQSGOVVFXKMC-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.03
Rot. Bonds5

About 1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine

1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine (PubChem CID 62724590) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine
PubChem CID62724590
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine
SMILESCNCC1(Cc2ncc(C)c(OC)c2C)CCCC1
InChIInChI=1S/C16H26N2O/c1-12-10-18-14(13(2)15(12)19-4)9-16(11-17-3)7-5-6-8-16/h10,17H,5-9,11H2,1-4H3
InChIKeyMXQQSGOVVFXKMC-UHFFFAOYSA-N
XLogP3.03
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclobutyl]-N-methylmethanamine
CID 65194645
1-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]oxan-4-yl]-N-methylmethanamine
CID 62906948
N-[[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopropyl]methyl]-2-methylpropan-1-amine
CID 66025589
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol
CID 65142759
N-[[1-(chloromethyl)cyclohexyl]methyl]-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)methanamine
CID 103969062
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexane-1-carbonitrile
CID 65376799
[3-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]methanol
CID 66058388
[2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thiolan-2-yl]methanamine
CID 83173757
3-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N,3-dimethylcyclopentan-1-amine
CID 116539196
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopropane-1-carboxylic acid
CID 66024192
1-[1-hydroxy-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]cyclopentan-1-ol
CID 103448486
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N,4-dimethylpiperidin-4-amine
CID 115304899

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine?
The IUPAC name of 1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine (CID 62724590) is 1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine?
The canonical SMILES for 1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine is CNCC1(Cc2ncc(C)c(OC)c2C)CCCC1.
What is the InChIKey of 1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine?
The InChIKey is MXQQSGOVVFXKMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-12-10-18-14(13(2)15(12)19-4)9-16(11-17-3)7-5-6-8-16/h10,17H,5-9,11H2,1-4H3.
What are the key properties of 1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine?
1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine has a molecular weight of 262.40 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine is sourced from PubChem (CID 62724590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).