N,N-diethyl-1-methylpyrrole-2-carboxamide

C10H16N2O — CID 60654004

IUPACN,N-diethyl-1-methylpyrrole-2-carboxamide
SMILESCCN(CC)C(=O)c1cccn1C
InChIInChI=1S/C10H16N2O/c1-4-12(5-2)10(13)9-7-6-8-11(9)3/h6-8H,4-5H2,1-3H3
InChIKeyMUAYMWCRNRTGKR-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.51
Rot. Bonds3

About N,N-diethyl-1-methylpyrrole-2-carboxamide

N,N-diethyl-1-methylpyrrole-2-carboxamide (PubChem CID 60654004) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is N,N-diethyl-1-methylpyrrole-2-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-1-methylpyrrole-2-carboxamide
PubChem CID60654004
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC NameN,N-diethyl-1-methylpyrrole-2-carboxamide
SMILESCCN(CC)C(=O)c1cccn1C
InChIInChI=1S/C10H16N2O/c1-4-12(5-2)10(13)9-7-6-8-11(9)3/h6-8H,4-5H2,1-3H3
InChIKeyMUAYMWCRNRTGKR-UHFFFAOYSA-N
XLogP1.51
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-1-methylpyrrole-2-carboxamide
CID 71944585
ethyl 2-[(1-methylpyrrole-2-carbonyl)-propylamino]acetate
CID 54898758
N-(1-hydroxypropan-2-yl)-N,1-dimethylpyrrole-2-carboxamide
CID 115765031
N-(1-aminopropan-2-yl)-N,1-dimethylpyrrole-2-carboxamide
CID 82505454
N-(2-chloroacetyl)-N,1-dimethylpyrrole-2-carboxamide
CID 28893231
2-[tert-butyl-(1-methylpyrrole-2-carbonyl)amino]acetic acid
CID 79265767
ethane;1-methyl-N-propylpyrrole-2-carboxamide
CID 143101069
1-methylpyrrole-2-carboxylic acid;hydrochloride
CID 69426436
1-methylpyrrole-2-carbonyl fluoride
CID 119090351
N,N-diethyl-1-[(2-iodophenyl)methyl]pyrrole-2-carboxamide
CID 15470746
[2-(1-methylpyrrol-2-yl)-2-oxoethyl]phosphonic acid
CID 161197491
3-[3-ethoxypropyl-(1-methylpyrrole-2-carbonyl)amino]-2-methylpropanoic acid
CID 119208607

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-methylpyrrole-2-carboxamide?
The IUPAC name of N,N-diethyl-1-methylpyrrole-2-carboxamide (CID 60654004) is N,N-diethyl-1-methylpyrrole-2-carboxamide.
What is the SMILES notation for N,N-diethyl-1-methylpyrrole-2-carboxamide?
The canonical SMILES for N,N-diethyl-1-methylpyrrole-2-carboxamide is CCN(CC)C(=O)c1cccn1C.
What is the InChIKey of N,N-diethyl-1-methylpyrrole-2-carboxamide?
The InChIKey is MUAYMWCRNRTGKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-4-12(5-2)10(13)9-7-6-8-11(9)3/h6-8H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-1-methylpyrrole-2-carboxamide?
N,N-diethyl-1-methylpyrrole-2-carboxamide has a molecular weight of 180.25 g/mol, XLogP of 1.51, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-methylpyrrole-2-carboxamide is sourced from PubChem (CID 60654004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).