[1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol

C12H19N3O — CID 106549888

IUPAC[1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol
SMILESCc1cnnc(NCC2(CO)CCCC2)c1
InChIInChI=1S/C12H19N3O/c1-10-6-11(15-14-7-10)13-8-12(9-16)4-2-3-5-12/h6-7,16H,2-5,8-9H2,1H3,(H,13,15)
InChIKeyCDZTYMCGLNHXCK-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.75
Rot. Bonds4

About [1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol

[1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol (PubChem CID 106549888) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is [1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol
PubChem CID106549888
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol
SMILESCc1cnnc(NCC2(CO)CCCC2)c1
InChIInChI=1S/C12H19N3O/c1-10-6-11(15-14-7-10)13-8-12(9-16)4-2-3-5-12/h6-7,16H,2-5,8-9H2,1H3,(H,13,15)
InChIKeyCDZTYMCGLNHXCK-UHFFFAOYSA-N
XLogP1.75
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(chloromethyl)cyclopentyl]methyl]-5-methylpyridazin-3-amine
CID 106550702
N-[[1-(2-chloroethyl)cyclopropyl]methyl]-5-methylpyridazin-3-amine
CID 106550743
5-methyl-N-[(4-methylpiperidin-4-yl)methyl]pyridazin-3-amine
CID 106550265
[1-[(pyrazin-2-ylamino)methyl]cyclopentyl]methanol
CID 115360623
[1-[[[6-(ethylamino)pyrimidin-4-yl]amino]methyl]cyclohexyl]methanol
CID 103968726
[1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol
CID 115360663
[1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol
CID 115455152
[1-[[(6-ethylpyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 112697562
N-[1-(chloromethyl)cyclohexyl]-5-methylpyridazin-3-amine
CID 106550652
[1-[[(6-chloropyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 115361870
[1-[[(6-ethoxypyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 103967277
[1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol
CID 79478877

Frequently Asked Questions

What is the IUPAC name of [1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol?
The IUPAC name of [1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol (CID 106549888) is [1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol is Cc1cnnc(NCC2(CO)CCCC2)c1.
What is the InChIKey of [1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol?
The InChIKey is CDZTYMCGLNHXCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-10-6-11(15-14-7-10)13-8-12(9-16)4-2-3-5-12/h6-7,16H,2-5,8-9H2,1H3,(H,13,15).
What are the key properties of [1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol?
[1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol has a molecular weight of 221.30 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 106549888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).