N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide

C10H18N4O — CID 63701216

IUPACN-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide
SMILESCN(C)CCCN(C)C(=O)c1cn[nH]c1
InChIInChI=1S/C10H18N4O/c1-13(2)5-4-6-14(3)10(15)9-7-11-12-8-9/h7-8H,4-6H2,1-3H3,(H,11,12)
InChIKeyUDTIJOWOJZCDTF-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.43
Rot. Bonds5

About N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide

N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide (PubChem CID 63701216) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide
PubChem CID63701216
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC NameN-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide
SMILESCN(C)CCCN(C)C(=O)c1cn[nH]c1
InChIInChI=1S/C10H18N4O/c1-13(2)5-4-6-14(3)10(15)9-7-11-12-8-9/h7-8H,4-6H2,1-3H3,(H,11,12)
InChIKeyUDTIJOWOJZCDTF-UHFFFAOYSA-N
XLogP0.43
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-bis[3-(dimethylamino)propyl]-1H-pyrazole-4-carboxamide
CID 60959519
4-[methyl(1H-pyrazole-4-carbonyl)amino]butanoic acid
CID 43565635
N-(5-chloropentyl)-N-methyl-1H-pyrazole-4-carboxamide
CID 107205772
N-[3-(dimethylamino)propyl]-N-ethyl-1H-pyrazole-4-carboxamide
CID 102978931
N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1H-pyrazole-4-carboxamide
CID 54877373
N-[3-(dimethylamino)propyl]-5-hydroxy-N-methylpyridine-3-carboxamide
CID 63860357
N,N-bis(2-methoxyethyl)-1H-pyrazole-4-carboxamide
CID 43533016
2,6-dichloro-N-[3-(dimethylamino)propyl]-N-methylpyridine-4-carboxamide
CID 55226569
N-(2-bromo-3-methoxypropyl)-N-methyl-1H-pyrazole-4-carboxamide
CID 80671538
4-amino-N-[3-(dimethylamino)propyl]-N-methylbenzamide
CID 22567507
5,6-dichloro-N-[3-(dimethylamino)propyl]-N-methylpyridine-3-carboxamide
CID 63695366
N-(2-aminoethyl)-N-ethyl-1H-pyrazole-4-carboxamide
CID 63085431

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide (CID 63701216) is N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide is CN(C)CCCN(C)C(=O)c1cn[nH]c1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide?
The InChIKey is UDTIJOWOJZCDTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-13(2)5-4-6-14(3)10(15)9-7-11-12-8-9/h7-8H,4-6H2,1-3H3,(H,11,12).
What are the key properties of N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide?
N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 0.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-N-methyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 63701216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).