(2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide

C22H28N4O2 — CID 40689904

IUPAC(2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide
SMILESCCn1c2ccccc2c2cc(NC(=O)[C@@H](C)N(C)CC(=O)N(C)C)ccc21
InChIInChI=1S/C22H28N4O2/c1-6-26-19-10-8-7-9-17(19)18-13-16(11-12-20(18)26)23-22(28)15(2)25(5)14-21(27)24(3)4/h7-13,15H,6,14H2,1-5H3,(H,23,28)/t15-/m1/s1
InChIKeyWDZWYUURSHOBNH-OAHLLOKOSA-N
MW380.49 g/mol
LogP3.16
Rot. Bonds6

About (2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide

(2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide (PubChem CID 40689904) has the molecular formula C22H28N4O2 and a molecular weight of 380.49 g/mol. Its IUPAC name is (2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide
PubChem CID40689904
Molecular FormulaC22H28N4O2
Molecular Weight380.49 g/mol
Exact Mass380.22
IUPAC Name(2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide
SMILESCCn1c2ccccc2c2cc(NC(=O)[C@@H](C)N(C)CC(=O)N(C)C)ccc21
InChIInChI=1S/C22H28N4O2/c1-6-26-19-10-8-7-9-17(19)18-13-16(11-12-20(18)26)23-22(28)15(2)25(5)14-21(27)24(3)4/h7-13,15H,6,14H2,1-5H3,(H,23,28)/t15-/m1/s1
InChIKeyWDZWYUURSHOBNH-OAHLLOKOSA-N
XLogP3.16
TPSA57.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(9-ethylcarbazol-3-yl)pentanamide
CID 120558708
2-(3,4-difluoro-N-methylsulfonylanilino)-N-(9-ethylcarbazol-3-yl)propanamide
CID 133161286
2-[carbamoyl(methyl)amino]-N-(9-ethylcarbazol-3-yl)acetamide
CID 9400428
N-(9-ethylcarbazol-3-yl)-2-methyl-3-pyridin-4-ylpropanamide
CID 70240283
(2R)-2-(4-aza-1-azoniabicyclo[2.2.2]octan-1-yl)-N-(9-ethylcarbazol-3-yl)propanamide
CID 2546572
(2S)-2-benzylsulfanyl-N-(9-ethylcarbazol-3-yl)propanamide
CID 124582604
N-(9-ethylcarbazol-3-yl)-2-(4-ethylpiperazin-1-yl)propanamide
CID 42911814
(2R)-N-(9-ethylcarbazol-3-yl)-2-(4-methylphenoxy)propanamide
CID 1019882
(2R)-N-(9-ethylcarbazol-3-yl)-2-(2-methylpyridin-1-ium-1-yl)propanamide
CID 8717773
N-(9-ethylcarbazol-3-yl)-2-sulfanylacetamide
CID 54424608
N-(4-cyanophenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]propanamide
CID 43215756
2-(4-bromophenoxy)-N-(9-ethylcarbazol-3-yl)propanamide
CID 18837985

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide?
The IUPAC name of (2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide (CID 40689904) is (2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide.
What is the SMILES notation for (2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide?
The canonical SMILES for (2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide is CCn1c2ccccc2c2cc(NC(=O)[C@@H](C)N(C)CC(=O)N(C)C)ccc21.
What is the InChIKey of (2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide?
The InChIKey is WDZWYUURSHOBNH-OAHLLOKOSA-N. The full InChI is InChI=1S/C22H28N4O2/c1-6-26-19-10-8-7-9-17(19)18-13-16(11-12-20(18)26)23-22(28)15(2)25(5)14-21(27)24(3)4/h7-13,15H,6,14H2,1-5H3,(H,23,28)/t15-/m1/s1.
What are the key properties of (2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide?
(2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide has a molecular weight of 380.49 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide is sourced from PubChem (CID 40689904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).