N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine

C18H25N3 — CID 65488451

IUPACN-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine
SMILESCC(C)NCc1ccc(N(C)CCc2ccccc2)nc1
InChIInChI=1S/C18H25N3/c1-15(2)19-13-17-9-10-18(20-14-17)21(3)12-11-16-7-5-4-6-8-16/h4-10,14-15,19H,11-13H2,1-3H3
InChIKeyUCPDHJIUMQEDEH-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.26
Rot. Bonds7

About N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine

N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine (PubChem CID 65488451) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine
PubChem CID65488451
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC NameN-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine
SMILESCC(C)NCc1ccc(N(C)CCc2ccccc2)nc1
InChIInChI=1S/C18H25N3/c1-15(2)19-13-17-9-10-18(20-14-17)21(3)12-11-16-7-5-4-6-8-16/h4-10,14-15,19H,11-13H2,1-3H3
InChIKeyUCPDHJIUMQEDEH-UHFFFAOYSA-N
XLogP3.26
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-5-[(propan-2-ylamino)methyl]-N-(2,2,2-trifluoroethyl)pyridin-2-amine
CID 62282456
N-(cyclobutylmethyl)-N-methyl-5-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62855473
N-methyl-5-(methylaminomethyl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine
CID 62284014
1-[[methyl-[5-[(propan-2-ylamino)methyl]-2-pyridinyl]amino]methyl]cyclopentan-1-ol
CID 114950640
N-(3,3-dimethylbutan-2-yl)-N-methyl-5-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62284058
2-[pentan-3-yl-[5-[(propan-2-ylamino)methyl]-2-pyridinyl]amino]ethanol
CID 80630615
N-(1-cyclopropylethyl)-N-methyl-5-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62281707
N-methyl-N-(3-methylphenyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62293176
N-methyl-5-(methylaminomethyl)-N-(2-methylpropyl)pyridin-2-amine
CID 62279559
N-(2-methoxyethyl)-N-methyl-5-[[[(1S)-1-phenyl-2-pyrrolidin-1-ylethyl]amino]methyl]pyridin-2-amine
CID 124726400
5-bromo-N-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]pyridin-2-amine
CID 115146878
N-(3-methoxyphenyl)-N-methyl-5-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62292816

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine?
The IUPAC name of N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine (CID 65488451) is N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine.
What is the SMILES notation for N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine?
The canonical SMILES for N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine is CC(C)NCc1ccc(N(C)CCc2ccccc2)nc1.
What is the InChIKey of N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine?
The InChIKey is UCPDHJIUMQEDEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-15(2)19-13-17-9-10-18(20-14-17)21(3)12-11-16-7-5-4-6-8-16/h4-10,14-15,19H,11-13H2,1-3H3.
What are the key properties of N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine?
N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine has a molecular weight of 283.42 g/mol, XLogP of 3.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-phenylethyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 65488451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).