N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine

C16H23N5 — CID 114555031

IUPACN-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
SMILESCCCn1nccc1CNc1cccnc1N1CCCC1
InChIInChI=1S/C16H23N5/c1-2-10-21-14(7-9-19-21)13-18-15-6-5-8-17-16(15)20-11-3-4-12-20/h5-9,18H,2-4,10-13H2,1H3
InChIKeyLAJDXYPHZSWDIZ-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.90
Rot. Bonds6

About N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine

N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine (PubChem CID 114555031) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
PubChem CID114555031
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC NameN-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
SMILESCCCn1nccc1CNc1cccnc1N1CCCC1
InChIInChI=1S/C16H23N5/c1-2-10-21-14(7-9-19-21)13-18-15-6-5-8-17-16(15)20-11-3-4-12-20/h5-9,18H,2-4,10-13H2,1H3
InChIKeyLAJDXYPHZSWDIZ-UHFFFAOYSA-N
XLogP2.90
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylaniline
CID 114555092
2-methylsulfanyl-N-[(2-propylpyrazol-3-yl)methyl]aniline
CID 114555084
N-[(2-ethylpyrazol-3-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine
CID 75505630
N-pentyl-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676361
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 60982261
N-[(5-methylthiophen-2-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676368
N-[(5-methylfuran-2-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676423
N-[(2-propylpyrazol-3-yl)methyl]piperidin-1-amine
CID 114556039
N-(furan-2-ylmethyl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676420
2-[(dimethylamino)methyl]-N-[(2-propylpyrazol-3-yl)methyl]aniline
CID 114555445
N-[(2-propylpyrazol-3-yl)methyl]-2-pyrazol-1-ylaniline
CID 114555172
N-[(1-methyltriazol-4-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 55113792

Frequently Asked Questions

What is the IUPAC name of N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine?
The IUPAC name of N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine (CID 114555031) is N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine.
What is the SMILES notation for N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine?
The canonical SMILES for N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine is CCCn1nccc1CNc1cccnc1N1CCCC1.
What is the InChIKey of N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine?
The InChIKey is LAJDXYPHZSWDIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-2-10-21-14(7-9-19-21)13-18-15-6-5-8-17-16(15)20-11-3-4-12-20/h5-9,18H,2-4,10-13H2,1H3.
What are the key properties of N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine?
N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine has a molecular weight of 285.39 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-propylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine is sourced from PubChem (CID 114555031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).