4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide

C14H25N5O — CID 102990884

IUPAC4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide
SMILESCCN(CCCN(C)C)C(=O)c1n[nH]c(C2CC2)c1N
InChIInChI=1S/C14H25N5O/c1-4-19(9-5-8-18(2)3)14(20)13-11(15)12(16-17-13)10-6-7-10/h10H,4-9,15H2,1-3H3,(H,16,17)
InChIKeyGOVUIYSPSQPTPP-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.28
Rot. Bonds7

About 4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide

4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide (PubChem CID 102990884) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is 4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide
PubChem CID102990884
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide
SMILESCCN(CCCN(C)C)C(=O)c1n[nH]c(C2CC2)c1N
InChIInChI=1S/C14H25N5O/c1-4-19(9-5-8-18(2)3)14(20)13-11(15)12(16-17-13)10-6-7-10/h10H,4-9,15H2,1-3H3,(H,16,17)
InChIKeyGOVUIYSPSQPTPP-UHFFFAOYSA-N
XLogP1.28
TPSA78.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide (CID 102990884) is 4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide is CCN(CCCN(C)C)C(=O)c1n[nH]c(C2CC2)c1N.
What is the InChIKey of 4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide?
The InChIKey is GOVUIYSPSQPTPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-4-19(9-5-8-18(2)3)14(20)13-11(15)12(16-17-13)10-6-7-10/h10H,4-9,15H2,1-3H3,(H,16,17).
What are the key properties of 4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide?
4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide has a molecular weight of 279.39 g/mol, XLogP of 1.28, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-cyclopropyl-N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 102990884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).