6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine

C18H30N4O — CID 97338496

IUPAC6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine
SMILESC[C@H](CC1CCOCC1)Nc1ccc(N2CCN(C)CC2)nc1
InChIInChI=1S/C18H30N4O/c1-15(13-16-5-11-23-12-6-16)20-17-3-4-18(19-14-17)22-9-7-21(2)8-10-22/h3-4,14-16,20H,5-13H2,1-2H3/t15-/m1/s1
InChIKeyDNWBSLOPIOZLLO-OAHLLOKOSA-N
MW318.46 g/mol
LogP2.45
Rot. Bonds5

About 6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine

6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine (PubChem CID 97338496) has the molecular formula C18H30N4O and a molecular weight of 318.46 g/mol. Its IUPAC name is 6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine.

Molecular Properties

Compound Name6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine
PubChem CID97338496
Molecular FormulaC18H30N4O
Molecular Weight318.46 g/mol
Exact Mass318.24
IUPAC Name6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine
SMILESC[C@H](CC1CCOCC1)Nc1ccc(N2CCN(C)CC2)nc1
InChIInChI=1S/C18H30N4O/c1-15(13-16-5-11-23-12-6-16)20-17-3-4-18(19-14-17)22-9-7-21(2)8-10-22/h3-4,14-16,20H,5-13H2,1-2H3/t15-/m1/s1
InChIKeyDNWBSLOPIOZLLO-OAHLLOKOSA-N
XLogP2.45
TPSA40.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine with MolForge

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Related Compounds

6-(4-methylpiperazin-1-yl)-N-[(2S)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine
CID 97338495
N-(1-cyclobutylpropan-2-yl)-6-pyrrolidin-1-ylpyridin-3-amine
CID 115922079
N-(1-cyclopentylethyl)-6-morpholin-4-ylpyridin-3-amine
CID 62631562
N-(1-cyclopropyl-2-methoxyethyl)-6-(4-methylpiperazin-1-yl)pyridin-3-amine
CID 75516866
6-(4-methylpiperazin-1-yl)-N-(1-propan-2-ylpiperidin-4-yl)pyridin-3-amine
CID 86787630
N-(oxolan-3-ylmethyl)-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689591
2-amino-N-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-2-(oxan-4-yl)acetamide;trihydrochloride
CID 120801577
N-pentan-2-yl-6-piperidin-1-ylpyridin-3-amine
CID 43690334
N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]ethanesulfonamide
CID 113011044
6-morpholin-4-yl-N-(1-pyridin-4-ylethyl)pyridin-3-amine
CID 43724774
3-amino-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]butanamide
CID 120872707
N-cyclopentyl-6-morpholin-4-ylpyridin-3-amine
CID 43724730

Frequently Asked Questions

What is the IUPAC name of 6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine?
The IUPAC name of 6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine (CID 97338496) is 6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine.
What is the SMILES notation for 6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine?
The canonical SMILES for 6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine is C[C@H](CC1CCOCC1)Nc1ccc(N2CCN(C)CC2)nc1.
What is the InChIKey of 6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine?
The InChIKey is DNWBSLOPIOZLLO-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H30N4O/c1-15(13-16-5-11-23-12-6-16)20-17-3-4-18(19-14-17)22-9-7-21(2)8-10-22/h3-4,14-16,20H,5-13H2,1-2H3/t15-/m1/s1.
What are the key properties of 6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine?
6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine has a molecular weight of 318.46 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylpiperazin-1-yl)-N-[(2R)-1-(oxan-4-yl)propan-2-yl]pyridin-3-amine is sourced from PubChem (CID 97338496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).