N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide

C15H27N5O — CID 60945562

IUPACN-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide
SMILESCCN(CC)CCn1cc(NC(=O)C2CCCNC2)cn1
InChIInChI=1S/C15H27N5O/c1-3-19(4-2)8-9-20-12-14(11-17-20)18-15(21)13-6-5-7-16-10-13/h11-13,16H,3-10H2,1-2H3,(H,18,21)
InChIKeyLECCGNHYYIKGDF-UHFFFAOYSA-N
MW293.41 g/mol
LogP1.16
Rot. Bonds7

About N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide

N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide (PubChem CID 60945562) has the molecular formula C15H27N5O and a molecular weight of 293.41 g/mol. Its IUPAC name is N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide
PubChem CID60945562
Molecular FormulaC15H27N5O
Molecular Weight293.41 g/mol
Exact Mass293.22
IUPAC NameN-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide
SMILESCCN(CC)CCn1cc(NC(=O)C2CCCNC2)cn1
InChIInChI=1S/C15H27N5O/c1-3-19(4-2)8-9-20-12-14(11-17-20)18-15(21)13-6-5-7-16-10-13/h11-13,16H,3-10H2,1-2H3,(H,18,21)
InChIKeyLECCGNHYYIKGDF-UHFFFAOYSA-N
XLogP1.16
TPSA62.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]pyrrolidine-2-carboxamide
CID 61163094
(3R)-N-[1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]piperidine-3-carboxamide
CID 81124070
(2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide
CID 103813844
N-(1-benzylpyrazol-4-yl)piperidine-3-carboxamide
CID 60946173
2-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]cyclopentane-1-carboxamide
CID 64823183
N-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]piperidine-3-carboxamide;dihydrochloride
CID 119871178
N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]piperidine-3-carboxamide;hydrochloride
CID 126786611
(3S)-N-(1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide
CID 81139176
N-[1-[2-(4-methoxyanilino)-2-oxoethyl]pyrazol-4-yl]piperidine-3-carboxamide;hydrochloride
CID 119309115
2-chloro-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]acetamide
CID 54867250
N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]butanamide
CID 47927357
2-[4-(cyclobutanecarbonylamino)pyrazol-1-yl]acetic acid
CID 61018747

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide?
The IUPAC name of N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide (CID 60945562) is N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide.
What is the SMILES notation for N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide?
The canonical SMILES for N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide is CCN(CC)CCn1cc(NC(=O)C2CCCNC2)cn1.
What is the InChIKey of N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide?
The InChIKey is LECCGNHYYIKGDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-3-19(4-2)8-9-20-12-14(11-17-20)18-15(21)13-6-5-7-16-10-13/h11-13,16H,3-10H2,1-2H3,(H,18,21).
What are the key properties of N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide?
N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide has a molecular weight of 293.41 g/mol, XLogP of 1.16, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide is sourced from PubChem (CID 60945562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).