1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol

C13H25N5O — CID 66056389

IUPAC1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol
SMILESCCc1nn(C)c(N2CC(O)CC2CN(C)C)c1N
InChIInChI=1S/C13H25N5O/c1-5-11-12(14)13(17(4)15-11)18-8-10(19)6-9(18)7-16(2)3/h9-10,19H,5-8,14H2,1-4H3
InChIKeyQQJQBIWIIWCNHF-UHFFFAOYSA-N
MW267.38 g/mol
LogP0.07
Rot. Bonds4

About 1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol

1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol (PubChem CID 66056389) has the molecular formula C13H25N5O and a molecular weight of 267.38 g/mol. Its IUPAC name is 1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol.

Molecular Properties

Compound Name1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol
PubChem CID66056389
Molecular FormulaC13H25N5O
Molecular Weight267.38 g/mol
Exact Mass267.21
IUPAC Name1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol
SMILESCCc1nn(C)c(N2CC(O)CC2CN(C)C)c1N
InChIInChI=1S/C13H25N5O/c1-5-11-12(14)13(17(4)15-11)18-8-10(19)6-9(18)7-16(2)3/h9-10,19H,5-8,14H2,1-4H3
InChIKeyQQJQBIWIIWCNHF-UHFFFAOYSA-N
XLogP0.07
TPSA70.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-(6-amino-2-methylpyrimidin-4-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 80856423
5-(2,4-dimethylpiperazin-1-yl)-3-ethyl-1-methylpyrazol-4-amine
CID 114086152
1-(3-amino-1,2,4-thiadiazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 66281221
5-(3,4-dimethylpyrrolidin-1-yl)-3-ethyl-1-methylpyrazol-4-amine
CID 79188895
5-[(dimethylamino)methyl]-1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidin-3-ol
CID 80937089
5-[(dimethylamino)methyl]-1-(3-ethyltriazol-4-yl)pyrrolidin-3-ol
CID 114223161
3-[1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)pyrrolidin-2-yl]propan-1-ol
CID 66016811
1-(3-amino-5-bromo-4-pyridinyl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 103518270
1-(2-aminopyrimidin-4-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 80856576
5-[(dimethylamino)methyl]-1-(1-methylimidazol-2-yl)pyrrolidin-3-ol
CID 66054145
5-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-ethyl-1-methylpyrazol-4-amine
CID 113335507
5-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-3-ethyl-1-methylpyrazol-4-amine
CID 66016774

Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol?
The IUPAC name of 1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol (CID 66056389) is 1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol.
What is the SMILES notation for 1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol?
The canonical SMILES for 1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol is CCc1nn(C)c(N2CC(O)CC2CN(C)C)c1N.
What is the InChIKey of 1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol?
The InChIKey is QQJQBIWIIWCNHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N5O/c1-5-11-12(14)13(17(4)15-11)18-8-10(19)6-9(18)7-16(2)3/h9-10,19H,5-8,14H2,1-4H3.
What are the key properties of 1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol?
1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol has a molecular weight of 267.38 g/mol, XLogP of 0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol is sourced from PubChem (CID 66056389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).