4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide

C14H25N5O — CID 66123805

IUPAC4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide
SMILESCCCN1CCC(NC(=O)c2c(N)c(C)nn2C)CC1
InChIInChI=1S/C14H25N5O/c1-4-7-19-8-5-11(6-9-19)16-14(20)13-12(15)10(2)17-18(13)3/h11H,4-9,15H2,1-3H3,(H,16,20)
InChIKeyDHPXQGFDTZKCDB-UHFFFAOYSA-N
MW279.39 g/mol
LogP0.91
Rot. Bonds4

About 4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide

4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide (PubChem CID 66123805) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is 4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide
PubChem CID66123805
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide
SMILESCCCN1CCC(NC(=O)c2c(N)c(C)nn2C)CC1
InChIInChI=1S/C14H25N5O/c1-4-7-19-8-5-11(6-9-19)16-14(20)13-12(15)10(2)17-18(13)3/h11H,4-9,15H2,1-3H3,(H,16,20)
InChIKeyDHPXQGFDTZKCDB-UHFFFAOYSA-N
XLogP0.91
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide?
The IUPAC name of 4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide (CID 66123805) is 4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide is CCCN1CCC(NC(=O)c2c(N)c(C)nn2C)CC1.
What is the InChIKey of 4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide?
The InChIKey is DHPXQGFDTZKCDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-4-7-19-8-5-11(6-9-19)16-14(20)13-12(15)10(2)17-18(13)3/h11H,4-9,15H2,1-3H3,(H,16,20).
What are the key properties of 4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide?
4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide has a molecular weight of 279.39 g/mol, XLogP of 0.91, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1,3-dimethyl-N-(1-propylpiperidin-4-yl)pyrazole-5-carboxamide is sourced from PubChem (CID 66123805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).