[1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol

C15H19N3O — CID 115360663

IUPAC[1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol
SMILESOCC1(CNc2cnnc3ccccc23)CCCC1
InChIInChI=1S/C15H19N3O/c19-11-15(7-3-4-8-15)10-16-14-9-17-18-13-6-2-1-5-12(13)14/h1-2,5-6,9,19H,3-4,7-8,10-11H2,(H,16,18)
InChIKeyRWZDHSNBIMWTLJ-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.59
Rot. Bonds4

About [1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol

[1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol (PubChem CID 115360663) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is [1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol
PubChem CID115360663
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name[1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol
SMILESOCC1(CNc2cnnc3ccccc23)CCCC1
InChIInChI=1S/C15H19N3O/c19-11-15(7-3-4-8-15)10-16-14-9-17-18-13-6-2-1-5-12(13)14/h1-2,5-6,9,19H,3-4,7-8,10-11H2,(H,16,18)
InChIKeyRWZDHSNBIMWTLJ-UHFFFAOYSA-N
XLogP2.59
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(chloromethyl)cyclopropyl]methyl]cinnolin-4-amine
CID 115455792
N-[(1-cyclopropylcyclopropyl)methyl]cinnolin-4-amine
CID 114096455
N-[(1-aminocyclobutyl)methyl]cinnolin-4-amine
CID 103353871
1-[(cinnolin-4-ylamino)methyl]-4-methylcyclohexan-1-ol
CID 65118174
[1-[(2,1-benzothiazol-3-ylamino)methyl]cyclopentyl]methanol
CID 113294048
4-[[1-(hydroxymethyl)cyclopentyl]methylamino]cinnoline-3-carbonitrile
CID 115360612
1-[(cinnolin-4-ylamino)methyl]-4-ethylcyclohexan-1-ol
CID 65120155
[1-[[(3-aminoquinolin-4-yl)amino]methyl]cyclohexyl]methanol
CID 103965467
[1-[[(4-methylphthalazin-1-yl)amino]methyl]cyclopentyl]methanol
CID 115360695
3-(cinnolin-4-ylamino)-2-hydroxypropanamide
CID 114153484
[1-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol
CID 106549888
4-[(cinnolin-4-ylamino)methyl]benzoic acid
CID 63587099

Frequently Asked Questions

What is the IUPAC name of [1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol?
The IUPAC name of [1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol (CID 115360663) is [1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol.
What is the SMILES notation for [1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol?
The canonical SMILES for [1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol is OCC1(CNc2cnnc3ccccc23)CCCC1.
What is the InChIKey of [1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol?
The InChIKey is RWZDHSNBIMWTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c19-11-15(7-3-4-8-15)10-16-14-9-17-18-13-6-2-1-5-12(13)14/h1-2,5-6,9,19H,3-4,7-8,10-11H2,(H,16,18).
What are the key properties of [1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol?
[1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol has a molecular weight of 257.34 g/mol, XLogP of 2.59, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(cinnolin-4-ylamino)methyl]cyclopentyl]methanol is sourced from PubChem (CID 115360663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).