1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide

C15H26N4O — CID 79720334

IUPAC1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide
SMILESCCCN(CC1CCNCC1)C(=O)c1cnn(C)c1C
InChIInChI=1S/C15H26N4O/c1-4-9-19(11-13-5-7-16-8-6-13)15(20)14-10-17-18(3)12(14)2/h10,13,16H,4-9,11H2,1-3H3
InChIKeyMJQFNZFJJAFMBT-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.58
Rot. Bonds5

About 1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide

1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide (PubChem CID 79720334) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide.

Molecular Properties

Compound Name1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide
PubChem CID79720334
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide
SMILESCCCN(CC1CCNCC1)C(=O)c1cnn(C)c1C
InChIInChI=1S/C15H26N4O/c1-4-9-19(11-13-5-7-16-8-6-13)15(20)14-10-17-18(3)12(14)2/h10,13,16H,4-9,11H2,1-3H3
InChIKeyMJQFNZFJJAFMBT-UHFFFAOYSA-N
XLogP1.58
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromoethyl)-1,5-dimethyl-N-propylpyrazole-4-carboxamide
CID 80665959
5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide
CID 79720330
1-methyl-5-[[piperidin-4-ylmethyl(propyl)amino]methyl]pyrazole-4-carboxylic acid
CID 116632449
N-(cyclopropylmethyl)-1,5-dimethyl-N-prop-2-ynylpyrazole-4-carboxamide
CID 115532694
4-iodo-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79721151
2,4-dioxo-N-(piperidin-4-ylmethyl)-N-propyl-1H-pyrimidine-5-carboxamide
CID 79701435
3-methyl-N-(piperidin-4-ylmethyl)-N-propylfuran-2-carboxamide
CID 79720557
3-bromo-5-methyl-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 115999695
2,4-dichloro-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79700911
2,6-dichloro-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79702520
5-chloro-2-hydroxy-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79702379
N,N-bis(2-hydroxyethyl)-1,5-dimethylpyrazole-4-carboxamide
CID 61234511

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide?
The IUPAC name of 1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide (CID 79720334) is 1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide.
What is the SMILES notation for 1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide?
The canonical SMILES for 1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide is CCCN(CC1CCNCC1)C(=O)c1cnn(C)c1C.
What is the InChIKey of 1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide?
The InChIKey is MJQFNZFJJAFMBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-4-9-19(11-13-5-7-16-8-6-13)15(20)14-10-17-18(3)12(14)2/h10,13,16H,4-9,11H2,1-3H3.
What are the key properties of 1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide?
1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide is sourced from PubChem (CID 79720334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).