[1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol

C13H20N2O2 — CID 113371010

IUPAC[1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol
SMILESCOc1cccnc1NCC1(CO)CCCC1
InChIInChI=1S/C13H20N2O2/c1-17-11-5-4-8-14-12(11)15-9-13(10-16)6-2-3-7-13/h4-5,8,16H,2-3,6-7,9-10H2,1H3,(H,14,15)
InChIKeyNFACDEZFPJBRDV-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.05
Rot. Bonds5

About [1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol

[1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol (PubChem CID 113371010) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is [1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol
PubChem CID113371010
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name[1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol
SMILESCOc1cccnc1NCC1(CO)CCCC1
InChIInChI=1S/C13H20N2O2/c1-17-11-5-4-8-14-12(11)15-9-13(10-16)6-2-3-7-13/h4-5,8,16H,2-3,6-7,9-10H2,1H3,(H,14,15)
InChIKeyNFACDEZFPJBRDV-UHFFFAOYSA-N
XLogP2.05
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[[(3-fluoro-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 115360754
[1-[[(3-methylsulfonyl-2-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 114599025
ethyl 2-[[1-(hydroxymethyl)cyclohexyl]methylamino]pyridine-3-carboxylate
CID 103967298
2-[(3-methoxy-2-pyridinyl)amino]acetic acid
CID 83828470
[1-[[(2-methoxyphenyl)methylamino]methyl]cyclopentyl]methanol
CID 115358929
[1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 106660625
6-[(3-methoxy-2-pyridinyl)amino]hexan-1-ol
CID 107848736
3-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxylic acid
CID 115363234
[1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 103965461
2,2-difluoro-3-[(3-methoxy-2-pyridinyl)amino]propan-1-ol
CID 106171996
[1-[[[(1S)-1-(2-methoxyphenyl)ethyl]amino]methyl]cyclohexyl]methanol
CID 81419393
[1-[(5-fluoro-2-methoxyanilino)methyl]cyclobutyl]methanol
CID 115246686

Frequently Asked Questions

What is the IUPAC name of [1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The IUPAC name of [1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol (CID 113371010) is [1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol is COc1cccnc1NCC1(CO)CCCC1.
What is the InChIKey of [1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The InChIKey is NFACDEZFPJBRDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-17-11-5-4-8-14-12(11)15-9-13(10-16)6-2-3-7-13/h4-5,8,16H,2-3,6-7,9-10H2,1H3,(H,14,15).
What are the key properties of [1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
[1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol has a molecular weight of 236.31 g/mol, XLogP of 2.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 113371010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).