N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide

C14H25N5O2 — CID 106618071

IUPACN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide
SMILESCc1n[nH]c(C)c1NC(=O)CN(CCO)CC1CCCN1
InChIInChI=1S/C14H25N5O2/c1-10-14(11(2)18-17-10)16-13(21)9-19(6-7-20)8-12-4-3-5-15-12/h12,15,20H,3-9H2,1-2H3,(H,16,21)(H,17,18)
InChIKeyAAUQVJOSPSOFDV-UHFFFAOYSA-N
MW295.39 g/mol
LogP0.01
Rot. Bonds7

About N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide (PubChem CID 106618071) has the molecular formula C14H25N5O2 and a molecular weight of 295.39 g/mol. Its IUPAC name is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide
PubChem CID106618071
Molecular FormulaC14H25N5O2
Molecular Weight295.39 g/mol
Exact Mass295.20
IUPAC NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide
SMILESCc1n[nH]c(C)c1NC(=O)CN(CCO)CC1CCCN1
InChIInChI=1S/C14H25N5O2/c1-10-14(11(2)18-17-10)16-13(21)9-19(6-7-20)8-12-4-3-5-15-12/h12,15,20H,3-9H2,1-2H3,(H,16,21)(H,17,18)
InChIKeyAAUQVJOSPSOFDV-UHFFFAOYSA-N
XLogP0.01
TPSA93.28 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 50.01
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119681127
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-N-(3-methylphenyl)acetamide
CID 106617904
N-(4-fluorophenyl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106617853
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(methyl)amino]acetamide
CID 60683878
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106617908
ethyl 2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetate
CID 106617961
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-N-(1-methoxypropan-2-yl)acetamide
CID 106617890
methyl 2-[[2-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]-2-oxoethyl]-propylamino]acetate
CID 62013494
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-N,N-dipropylacetamide
CID 106617900
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-N-(prop-2-enylcarbamoyl)acetamide
CID 106618204
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-N'-pyridin-2-ylacetohydrazide
CID 106618022
2-[[2-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]-2-oxoethyl]-ethylamino]acetic acid
CID 54900293

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide?
The IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide (CID 106618071) is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide.
What is the SMILES notation for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide?
The canonical SMILES for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide is Cc1n[nH]c(C)c1NC(=O)CN(CCO)CC1CCCN1.
What is the InChIKey of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide?
The InChIKey is AAUQVJOSPSOFDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O2/c1-10-14(11(2)18-17-10)16-13(21)9-19(6-7-20)8-12-4-3-5-15-12/h12,15,20H,3-9H2,1-2H3,(H,16,21)(H,17,18).
What are the key properties of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide?
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide has a molecular weight of 295.39 g/mol, XLogP of 0.01, 7 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide is sourced from PubChem (CID 106618071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).