N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine

C14H17N3 — CID 113482648

IUPACN-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine
SMILESCCc1cccnc1CNc1ccnc(C)c1
InChIInChI=1S/C14H17N3/c1-3-12-5-4-7-16-14(12)10-17-13-6-8-15-11(2)9-13/h4-9H,3,10H2,1-2H3,(H,15,17)
InChIKeyCGXYBWOJLUMVTO-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.96
Rot. Bonds4

About N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine

N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine (PubChem CID 113482648) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine.

Molecular Properties

Compound NameN-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine
PubChem CID113482648
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC NameN-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine
SMILESCCc1cccnc1CNc1ccnc(C)c1
InChIInChI=1S/C14H17N3/c1-3-12-5-4-7-16-14(12)10-17-13-6-8-15-11(2)9-13/h4-9H,3,10H2,1-2H3,(H,15,17)
InChIKeyCGXYBWOJLUMVTO-UHFFFAOYSA-N
XLogP2.96
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[[(2-methyl-4-pyridinyl)amino]methyl]phenyl]acetic acid
CID 113482465
2-[(3-ethyl-2-pyridinyl)methylamino]-6-methylpyrimidine-4-carboxylic acid
CID 107554285
2-ethoxy-4-N-[(3-ethyl-2-pyridinyl)methyl]benzene-1,4-diamine
CID 82741640
N-[(3-ethyl-2-pyridinyl)methyl]-4-methylsulfonylaniline
CID 82739933
N-[(3-ethyl-2-pyridinyl)methyl]-1,3,4-thiadiazol-2-amine
CID 82739373
3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]-5,6-dimethylpyrazin-2-amine
CID 82749017
1-N-[(3-ethyl-2-pyridinyl)methyl]-4-nitrobenzene-1,3-diamine
CID 106749506
N-[(3-ethyl-2-pyridinyl)methyl]-5,6-dimethyl-1,2,4-triazin-3-amine
CID 114786832
N-[(3-ethyl-2-pyridinyl)methyl]-6-methyl-2-propan-2-ylpyrimidin-4-amine
CID 82739374
2,3-diethylpyridine
CID 14747123
2-methyl-N-propylpyridin-4-amine
CID 79240818
1-(3,5-dimethylphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
CID 82731760

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine?
The IUPAC name of N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine (CID 113482648) is N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine.
What is the SMILES notation for N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine?
The canonical SMILES for N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine is CCc1cccnc1CNc1ccnc(C)c1.
What is the InChIKey of N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine?
The InChIKey is CGXYBWOJLUMVTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-3-12-5-4-7-16-14(12)10-17-13-6-8-15-11(2)9-13/h4-9H,3,10H2,1-2H3,(H,15,17).
What are the key properties of N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine?
N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine has a molecular weight of 227.31 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethyl-2-pyridinyl)methyl]-2-methylpyridin-4-amine is sourced from PubChem (CID 113482648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).