N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine

C14H21N5 — CID 62208787

IUPACN-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine
SMILESCCNc1ccc(CN(C)Cc2cnn(C)c2)cn1
InChIInChI=1S/C14H21N5/c1-4-15-14-6-5-12(7-16-14)9-18(2)10-13-8-17-19(3)11-13/h5-8,11H,4,9-10H2,1-3H3,(H,15,16)
InChIKeyOBURBSJHWIVUES-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.88
Rot. Bonds6

About N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine

N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine (PubChem CID 62208787) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine
PubChem CID62208787
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC NameN-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine
SMILESCCNc1ccc(CN(C)Cc2cnn(C)c2)cn1
InChIInChI=1S/C14H21N5/c1-4-15-14-6-5-12(7-16-14)9-18(2)10-13-8-17-19(3)11-13/h5-8,11H,4,9-10H2,1-3H3,(H,15,16)
InChIKeyOBURBSJHWIVUES-UHFFFAOYSA-N
XLogP1.88
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine
CID 62208786
5-[[benzyl(methyl)amino]methyl]-N-ethylpyridin-2-amine
CID 55046066
N-ethyl-5-[[methyl-[(1-methylimidazol-2-yl)methyl]amino]methyl]pyridin-2-amine
CID 55145577
1-(4-fluorophenyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]methanamine
CID 22196060
1-[[[6-(ethylamino)-3-pyridinyl]methyl-methylamino]methyl]cyclopentan-1-ol
CID 114953204
N,N-dimethyl-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]aniline
CID 75402177
[4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenyl]methanamine
CID 61438389
N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-6-(propylamino)pyridine-3-carboxamide
CID 62176856
N-methyl-2-[4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenyl]ethanamine
CID 105347516
5-[[cycloheptyl(methyl)amino]methyl]-N-ethylpyridin-2-amine
CID 62183656
6-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]-N-propylpyridin-2-amine
CID 79244019
N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-1-(4-pyrazol-1-ylphenyl)methanamine
CID 34898028

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine?
The IUPAC name of N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine (CID 62208787) is N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine.
What is the SMILES notation for N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine?
The canonical SMILES for N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine is CCNc1ccc(CN(C)Cc2cnn(C)c2)cn1.
What is the InChIKey of N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine?
The InChIKey is OBURBSJHWIVUES-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-4-15-14-6-5-12(7-16-14)9-18(2)10-13-8-17-19(3)11-13/h5-8,11H,4,9-10H2,1-3H3,(H,15,16).
What are the key properties of N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine?
N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine has a molecular weight of 259.36 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyridin-2-amine is sourced from PubChem (CID 62208787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).