N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine

C15H17N3O3 — CID 6146230

IUPACN-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine
SMILESCOc1ccc(/C=N\Nc2ccccn2)c(OC)c1OC
InChIInChI=1S/C15H17N3O3/c1-19-12-8-7-11(14(20-2)15(12)21-3)10-17-18-13-6-4-5-9-16-13/h4-10H,1-3H3,(H,16,18)/b17-10-
InChIKeyZFSCKBHLUILGCT-YVLHZVERSA-N
MW287.32 g/mol
LogP2.55
Rot. Bonds6

About N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine

N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine (PubChem CID 6146230) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine.

Molecular Properties

Compound NameN-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine
PubChem CID6146230
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine
SMILESCOc1ccc(/C=N\Nc2ccccn2)c(OC)c1OC
InChIInChI=1S/C15H17N3O3/c1-19-12-8-7-11(14(20-2)15(12)21-3)10-17-18-13-6-4-5-9-16-13/h4-10H,1-3H3,(H,16,18)/b17-10-
InChIKeyZFSCKBHLUILGCT-YVLHZVERSA-N
XLogP2.55
TPSA64.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(2,3,4-trimethoxyphenyl)methylideneamino]aniline
CID 5062184
N-[(E)-(3,5-dibromo-2,4-dimethoxyphenyl)methylideneamino]pyridin-2-amine
CID 110505661
N-[[2-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]pyridin-2-amine
CID 110842527
N-[[2-[(3,4-dichlorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]pyridin-2-amine
CID 110842528
N-[(2,4,6-trimethoxyphenyl)methylideneamino]pyridin-2-amine
CID 4235681
2-methoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol
CID 3709889
2,3,4,5,6-pentafluoro-N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]aniline
CID 9466478
2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol
CID 135439965
N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]-3-nitropyridin-2-amine
CID 126101162
N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]pyridin-2-amine
CID 5008756
1-phenyl-N-[(2,3,4-trimethoxyphenyl)methylideneamino]methanamine
CID 3287826
N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]acridin-9-amine
CID 45481473

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine?
The IUPAC name of N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine (CID 6146230) is N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine.
What is the SMILES notation for N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine?
The canonical SMILES for N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine is COc1ccc(/C=N\Nc2ccccn2)c(OC)c1OC.
What is the InChIKey of N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine?
The InChIKey is ZFSCKBHLUILGCT-YVLHZVERSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-19-12-8-7-11(14(20-2)15(12)21-3)10-17-18-13-6-4-5-9-16-13/h4-10H,1-3H3,(H,16,18)/b17-10-.
What are the key properties of N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine?
N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine has a molecular weight of 287.32 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine is sourced from PubChem (CID 6146230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).