4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide

C10H18N4O — CID 82945173

IUPAC4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide
SMILESCC(CN(C)C)NC(=O)c1cc(N)c[nH]1
InChIInChI=1S/C10H18N4O/c1-7(6-14(2)3)13-10(15)9-4-8(11)5-12-9/h4-5,7,12H,6,11H2,1-3H3,(H,13,15)
InChIKeyZZVSBEMHHCJYNM-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.28
Rot. Bonds4

About 4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide

4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide (PubChem CID 82945173) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide
PubChem CID82945173
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide
SMILESCC(CN(C)C)NC(=O)c1cc(N)c[nH]1
InChIInChI=1S/C10H18N4O/c1-7(6-14(2)3)13-10(15)9-4-8(11)5-12-9/h4-5,7,12H,6,11H2,1-3H3,(H,13,15)
InChIKeyZZVSBEMHHCJYNM-UHFFFAOYSA-N
XLogP0.28
TPSA74.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-butan-2-yl-1H-pyrrole-2-carboxamide
CID 43641940
4-amino-N-(2-hydroxypropyl)-1H-pyrrole-2-carboxamide
CID 43643618
4-amino-N-[1-(dimethylamino)propan-2-yl]-1-methylpyrrole-2-carboxamide
CID 82945823
4-amino-N-[1-(4-chlorophenyl)ethyl]-1H-pyrrole-2-carboxamide
CID 61117966
4-amino-N-octan-4-yl-1H-pyrrole-2-carboxamide
CID 106021614
2-amino-N-[1-(dimethylamino)propan-2-yl]benzamide
CID 82946038
4-carbamothioyl-N-[1-(dimethylamino)propan-2-yl]benzamide
CID 82939675
5-amino-N-[1-(dimethylamino)propan-2-yl]-1-benzofuran-2-carboxamide
CID 82946153
1-(4-amino-1H-pyrrol-2-yl)-2-methylpropan-1-one
CID 131275798
4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrazole-5-carboxamide
CID 82944742
4-amino-N-[2-(2-methylpropylamino)-2-oxoethyl]-1H-pyrrole-2-carboxamide
CID 113404969
4-amino-N-(2-propan-2-yloxyethyl)-1H-pyrrole-2-carboxamide
CID 104758195

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide?
The IUPAC name of 4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide (CID 82945173) is 4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide?
The canonical SMILES for 4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide is CC(CN(C)C)NC(=O)c1cc(N)c[nH]1.
What is the InChIKey of 4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide?
The InChIKey is ZZVSBEMHHCJYNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-7(6-14(2)3)13-10(15)9-4-8(11)5-12-9/h4-5,7,12H,6,11H2,1-3H3,(H,13,15).
What are the key properties of 4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide?
4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 0.28, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[1-(dimethylamino)propan-2-yl]-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 82945173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).