N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide

C15H26N4O — CID 43319374

IUPACN-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide
SMILESCc1c(C(=O)N(CCCN)C2CCCCC2)cnn1C
InChIInChI=1S/C15H26N4O/c1-12-14(11-17-18(12)2)15(20)19(10-6-9-16)13-7-4-3-5-8-13/h11,13H,3-10,16H2,1-2H3
InChIKeyUOZUOEVVAHMSPG-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.85
Rot. Bonds5

About N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide

N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide (PubChem CID 43319374) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide
PubChem CID43319374
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide
SMILESCc1c(C(=O)N(CCCN)C2CCCCC2)cnn1C
InChIInChI=1S/C15H26N4O/c1-12-14(11-17-18(12)2)15(20)19(10-6-9-16)13-7-4-3-5-8-13/h11,13H,3-10,16H2,1-2H3
InChIKeyUOZUOEVVAHMSPG-UHFFFAOYSA-N
XLogP1.85
TPSA64.15 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 ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-aminopropyl)-N-cyclopentyl-1,3-dimethylpyrazole-4-carboxamide
CID 102801032
N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide
CID 62830761
N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide
CID 103115758
N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide
CID 43319365
N-cyclohexyl-1,5-dimethyl-N-(pyridin-3-ylmethyl)pyrazole-4-carboxamide
CID 77082758
N-(3-aminopropyl)-N-cyclopentyl-3-ethyl-1-methylpyrazole-4-carboxamide
CID 102809889
N-(3-aminopropyl)-N-cyclobutyl-2-methylbenzamide
CID 102873748
1-(3-aminopropyl)-N-cyclopropyl-5-methyl-N-(3-methylbutyl)pyrazole-4-carboxamide
CID 78977040
N-(3-aminopropyl)-N-cyclohexyl-2-fluoro-5-methylbenzamide
CID 62515468
N-(3-aminopropyl)-1,5-dimethyl-N-(2-methylphenyl)pyrazole-4-carboxamide
CID 43318651
N-(3-aminopropyl)-N-cycloheptylpyridazine-4-carboxamide
CID 104668877
N-[2-(diethylamino)ethyl]-N-[(3R)-1,1-dioxothiolan-3-yl]-1,5-dimethylpyrazole-4-carboxamide
CID 97099488

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide (CID 43319374) is N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide is Cc1c(C(=O)N(CCCN)C2CCCCC2)cnn1C.
What is the InChIKey of N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide?
The InChIKey is UOZUOEVVAHMSPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-12-14(11-17-18(12)2)15(20)19(10-6-9-16)13-7-4-3-5-8-13/h11,13H,3-10,16H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide?
N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide is sourced from PubChem (CID 43319374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).