N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine

C19H25N3 — CID 133481650

IUPACN,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine
SMILESCc1cccc(N(C)Cc2ccc(N3CCCCC3)cc2)n1
InChIInChI=1S/C19H25N3/c1-16-7-6-8-19(20-16)21(2)15-17-9-11-18(12-10-17)22-13-4-3-5-14-22/h6-12H,3-5,13-15H2,1-2H3
InChIKeyDAVCWMHVRJXHSS-UHFFFAOYSA-N
MW295.43 g/mol
LogP4.02
Rot. Bonds4

About N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine

N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine (PubChem CID 133481650) has the molecular formula C19H25N3 and a molecular weight of 295.43 g/mol. Its IUPAC name is N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine
PubChem CID133481650
Molecular FormulaC19H25N3
Molecular Weight295.43 g/mol
Exact Mass295.20
IUPAC NameN,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine
SMILESCc1cccc(N(C)Cc2ccc(N3CCCCC3)cc2)n1
InChIInChI=1S/C19H25N3/c1-16-7-6-8-19(20-16)21(2)15-17-9-11-18(12-10-17)22-13-4-3-5-14-22/h6-12H,3-5,13-15H2,1-2H3
InChIKeyDAVCWMHVRJXHSS-UHFFFAOYSA-N
XLogP4.02
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine?
The IUPAC name of N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine (CID 133481650) is N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine.
What is the SMILES notation for N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine?
The canonical SMILES for N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine is Cc1cccc(N(C)Cc2ccc(N3CCCCC3)cc2)n1.
What is the InChIKey of N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine?
The InChIKey is DAVCWMHVRJXHSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3/c1-16-7-6-8-19(20-16)21(2)15-17-9-11-18(12-10-17)22-13-4-3-5-14-22/h6-12H,3-5,13-15H2,1-2H3.
What are the key properties of N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine?
N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine has a molecular weight of 295.43 g/mol, XLogP of 4.02, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyridin-2-amine is sourced from PubChem (CID 133481650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).