N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine

C14H20N4 — CID 61272120

IUPACN-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine
SMILESCCCNC(C)c1cnn(-c2ccccn2)c1C
InChIInChI=1S/C14H20N4/c1-4-8-15-11(2)13-10-17-18(12(13)3)14-7-5-6-9-16-14/h5-7,9-11,15H,4,8H2,1-3H3
InChIKeyVWJFUWYZSQNEFU-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.64
Rot. Bonds5

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

N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine (PubChem CID 61272120) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine
PubChem CID61272120
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC NameN-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine
SMILESCCCNC(C)c1cnn(-c2ccccn2)c1C
InChIInChI=1S/C14H20N4/c1-4-8-15-11(2)13-10-17-18(12(13)3)14-7-5-6-9-16-14/h5-7,9-11,15H,4,8H2,1-3H3
InChIKeyVWJFUWYZSQNEFU-UHFFFAOYSA-N
XLogP2.64
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethanamine
CID 61271924
1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethanamine
CID 5200441
N-[1-(2-pyridin-2-yl-1,2,4-triazol-3-yl)ethyl]propan-1-amine
CID 135185533
(1R)-N-[(4-cyclopropyl-1,3-thiazol-2-yl)methyl]-1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethanamine
CID 97103526
1-(5-methyl-1-phenylpyrazol-4-yl)-N-[(1-pyridin-2-ylpyrrol-2-yl)methyl]ethanamine
CID 45219969
N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]-1-pyridin-2-ylpyrrolidin-3-amine
CID 75441632
(2R)-1-(5-methyl-1H-pyrazol-3-yl)-N-[(1S)-1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-2-amine
CID 97104052
N-[1-[5-methyl-1-(2,4,6-trimethylphenyl)pyrazol-4-yl]ethyl]propan-1-amine
CID 62797527
2-methyl-5-[[(1R)-1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]amino]benzamide
CID 99776917
N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]-2-(4-methylsulfanylphenyl)acetamide
CID 45228613
N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]-2-(1-methylpyrrol-3-yl)acetamide
CID 45169167
5-methyl-N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]thiophene-2-sulfonamide
CID 45232108

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine?
The IUPAC name of N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine (CID 61272120) is N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine is CCCNC(C)c1cnn(-c2ccccn2)c1C.
What is the InChIKey of N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine?
The InChIKey is VWJFUWYZSQNEFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-4-8-15-11(2)13-10-17-18(12(13)3)14-7-5-6-9-16-14/h5-7,9-11,15H,4,8H2,1-3H3.
What are the key properties of N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine?
N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine has a molecular weight of 244.34 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)ethyl]propan-1-amine is sourced from PubChem (CID 61272120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).