6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile

C12H15N3O — CID 65110570

IUPAC6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile
SMILESN#Cc1cccc(NCC2(O)CCCC2)n1
InChIInChI=1S/C12H15N3O/c13-8-10-4-3-5-11(15-10)14-9-12(16)6-1-2-7-12/h3-5,16H,1-2,6-7,9H2,(H,14,15)
InChIKeyUAVFJCPPSBSEPZ-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.67
Rot. Bonds3

About 6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile

6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile (PubChem CID 65110570) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile
PubChem CID65110570
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile
SMILESN#Cc1cccc(NCC2(O)CCCC2)n1
InChIInChI=1S/C12H15N3O/c13-8-10-4-3-5-11(15-10)14-9-12(16)6-1-2-7-12/h3-5,16H,1-2,6-7,9H2,(H,14,15)
InChIKeyUAVFJCPPSBSEPZ-UHFFFAOYSA-N
XLogP1.67
TPSA68.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[(6-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol
CID 65108918
1-[[[6-(ethylamino)-2-pyridinyl]amino]methyl]cyclohexan-1-ol
CID 80843577
1-[[(6-chloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
CID 65109143
6-[(1-ethylcyclopropyl)methylamino]pyridine-2-carbonitrile
CID 103736862
5-[(1-hydroxycyclopentyl)methylamino]pyrazine-2-carbonitrile
CID 65110472
3-amino-6-[(1-hydroxycyclobutyl)methylamino]pyridine-2-carbonitrile
CID 103469214
6-[(1-hydroxycyclohexyl)methylamino]-3-nitropyridine-2-carbonitrile
CID 103471774
2-chloro-6-[(1-hydroxycyclopentyl)methylamino]pyridine-4-carbonitrile
CID 83076259
2-[(1-hydroxycycloheptyl)methylamino]pyridine-4-carbonitrile
CID 65122274
6-(3-cyanopropylamino)pyridine-2-carbonitrile
CID 130778540
4-[[(6-hydrazinyl-2-pyridinyl)amino]methyl]oxan-4-ol
CID 81132046
1-[[(2-chloropyrimidin-4-yl)amino]methyl]cycloheptan-1-ol
CID 65122552

Frequently Asked Questions

What is the IUPAC name of 6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile?
The IUPAC name of 6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile (CID 65110570) is 6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile.
What is the SMILES notation for 6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile?
The canonical SMILES for 6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile is N#Cc1cccc(NCC2(O)CCCC2)n1.
What is the InChIKey of 6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile?
The InChIKey is UAVFJCPPSBSEPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c13-8-10-4-3-5-11(15-10)14-9-12(16)6-1-2-7-12/h3-5,16H,1-2,6-7,9H2,(H,14,15).
What are the key properties of 6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile?
6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile has a molecular weight of 217.27 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-hydroxycyclopentyl)methylamino]pyridine-2-carbonitrile is sourced from PubChem (CID 65110570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).