N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide

C14H24N4O — CID 66121370

IUPACN-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide
SMILESCCc1cc(C(=O)N(CCCN)C2CC2)n(CC)n1
InChIInChI=1S/C14H24N4O/c1-3-11-10-13(18(4-2)16-11)14(19)17(9-5-8-15)12-6-7-12/h10,12H,3-9,15H2,1-2H3
InChIKeyXFQFTMRFGHPJMQ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.42
Rot. Bonds7

About N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide

N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide (PubChem CID 66121370) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide
PubChem CID66121370
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide
SMILESCCc1cc(C(=O)N(CCCN)C2CC2)n(CC)n1
InChIInChI=1S/C14H24N4O/c1-3-11-10-13(18(4-2)16-11)14(19)17(9-5-8-15)12-6-7-12/h10,12H,3-9,15H2,1-2H3
InChIKeyXFQFTMRFGHPJMQ-UHFFFAOYSA-N
XLogP1.42
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[cyclopropyl-(1,3-diethylpyrazole-5-carbonyl)amino]propanoic acid
CID 66121181
N-(2-aminoethyl)-N-cyclopropyl-3-ethyl-1-methylpyrazole-5-carboxamide
CID 66121097
N-(2-aminoethyl)-N-butyl-1,3-diethylpyrazole-5-carboxamide
CID 66120244
N-(2-aminoethyl)-N-cyclohexyl-3-ethyl-1-methylpyrazole-5-carboxamide
CID 66121559
N-(2-aminoethyl)-N-cyclohexyl-2-ethyl-5-methylpyrazole-3-carboxamide
CID 66122641
N-(1-aminopropan-2-yl)-1,3-diethyl-N-methylpyrazole-5-carboxamide
CID 104556601
N-(2-aminoethyl)-1,3-diethylpyrazole-5-carboxamide
CID 66121952
N-(5-aminopentyl)-1,3-diethylpyrazole-5-carboxamide
CID 66120386
N-(8-azabicyclo[3.2.1]octan-3-yl)-1,3-diethyl-N-methylpyrazole-5-carboxamide
CID 66121022
[2-(3-aminopropyl)pyrrolidin-1-yl]-(1,3-diethylpyrazol-5-yl)methanone
CID 66121036
N-(2-cyanoethyl)-N-cyclopropyl-3-ethyl-1-methylpyrazole-5-carboxamide
CID 66120332
N-(3-aminopropyl)-N-cyclopropyl-4-ethylbenzamide
CID 43136724

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide (CID 66121370) is N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide is CCc1cc(C(=O)N(CCCN)C2CC2)n(CC)n1.
What is the InChIKey of N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide?
The InChIKey is XFQFTMRFGHPJMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-11-10-13(18(4-2)16-11)14(19)17(9-5-8-15)12-6-7-12/h10,12H,3-9,15H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide?
N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.42, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide is sourced from PubChem (CID 66121370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).