N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine

C14H20N4 — CID 82876645

IUPACN-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine
SMILESCCNC(Cc1cccnc1)Cc1ccn(C)n1
InChIInChI=1S/C14H20N4/c1-3-16-14(9-12-5-4-7-15-11-12)10-13-6-8-18(2)17-13/h4-8,11,14,16H,3,9-10H2,1-2H3
InChIKeyONFTTWBPXGZLPY-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.58
Rot. Bonds6

About N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine

N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine (PubChem CID 82876645) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine
PubChem CID82876645
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC NameN-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine
SMILESCCNC(Cc1cccnc1)Cc1ccn(C)n1
InChIInChI=1S/C14H20N4/c1-3-16-14(9-12-5-4-7-15-11-12)10-13-6-8-18(2)17-13/h4-8,11,14,16H,3,9-10H2,1-2H3
InChIKeyONFTTWBPXGZLPY-UHFFFAOYSA-N
XLogP1.58
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-ol
CID 82869029
1-(3,5-difluorophenyl)-N-ethyl-3-(1-methylpyrazol-3-yl)propan-2-amine
CID 82875994
1-(4-chlorophenyl)-N-ethyl-3-pyridin-3-ylpropan-2-amine
CID 62551023
N-ethyl-1-(4-propan-2-ylphenyl)-3-pyridin-3-ylpropan-2-amine
CID 62602849
N-ethyl-4,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine
CID 82876652
1-(3-bromophenyl)-N-ethyl-3-pyridin-3-ylpropan-2-amine
CID 62551546
1-(2-chlorophenyl)-N-ethyl-3-pyridin-3-ylpropan-2-amine
CID 55086568
4-ethoxy-N-ethyl-1-(1-methylpyrazol-3-yl)butan-2-amine
CID 105175167
N-ethyl-1-ethylsulfanyl-3-pyridin-3-ylpropan-2-amine
CID 104736340
N-ethyl-1-pyridin-3-ylpent-4-en-2-amine
CID 62551025
1-cyclopropyl-N-ethyl-3-(1-methylpyrazol-3-yl)propan-2-amine
CID 82876237
N-[(1-methylpyrazol-3-yl)methyl]-2-pyridin-3-ylethanamine
CID 78921214

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine?
The IUPAC name of N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine (CID 82876645) is N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine.
What is the SMILES notation for N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine?
The canonical SMILES for N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine is CCNC(Cc1cccnc1)Cc1ccn(C)n1.
What is the InChIKey of N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine?
The InChIKey is ONFTTWBPXGZLPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-3-16-14(9-12-5-4-7-15-11-12)10-13-6-8-18(2)17-13/h4-8,11,14,16H,3,9-10H2,1-2H3.
What are the key properties of N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine?
N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine has a molecular weight of 244.34 g/mol, XLogP of 1.58, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-amine is sourced from PubChem (CID 82876645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).