N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide

C25H30N4O3 — CID 27248278

IUPACN-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CN3CCN(C(=O)[C@@H]4CCCO4)CC3)ccc21
InChIInChI=1S/C25H30N4O3/c1-2-29-21-7-4-3-6-19(21)20-16-18(9-10-22(20)29)26-24(30)17-27-11-13-28(14-12-27)25(31)23-8-5-15-32-23/h3-4,6-7,9-10,16,23H,2,5,8,11-15,17H2,1H3,(H,26,30)/t23-/m0/s1
InChIKeyKRPSCKHIMHTEON-QHCPKHFHSA-N
MW434.54 g/mol
LogP3.08
Rot. Bonds5

About N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide

N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide (PubChem CID 27248278) has the molecular formula C25H30N4O3 and a molecular weight of 434.54 g/mol. Its IUPAC name is N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide
PubChem CID27248278
Molecular FormulaC25H30N4O3
Molecular Weight434.54 g/mol
Exact Mass434.23
IUPAC NameN-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CN3CCN(C(=O)[C@@H]4CCCO4)CC3)ccc21
InChIInChI=1S/C25H30N4O3/c1-2-29-21-7-4-3-6-19(21)20-16-18(9-10-22(20)29)26-24(30)17-27-11-13-28(14-12-27)25(31)23-8-5-15-32-23/h3-4,6-7,9-10,16,23H,2,5,8,11-15,17H2,1H3,(H,26,30)/t23-/m0/s1
InChIKeyKRPSCKHIMHTEON-QHCPKHFHSA-N
XLogP3.08
TPSA66.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.54
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-acetylphenyl)-2-[4-(oxolane-2-carbonyl)piperazin-1-yl]acetamide
CID 22197270
N-(3,5-dimethylphenyl)-2-[4-(oxolane-2-carbonyl)piperazin-1-yl]acetamide
CID 6464827
N-(4-bromophenyl)-2-[4-(oxolane-2-carbonyl)piperazin-1-yl]acetamide
CID 6464785
N-(9-ethylcarbazol-3-yl)-2-[4-(2-hydroxyanilino)piperidin-1-yl]acetamide
CID 24985386
ethyl 4-[[2-[4-(oxolane-2-carbonyl)piperazin-1-yl]acetyl]amino]benzoate
CID 6467490
N-[4-(3-methylphenoxy)phenyl]-2-[4-(oxolane-2-carbonyl)piperazin-1-yl]acetamide
CID 42897369
2-[[2-[4-(oxolane-2-carbonyl)piperazin-1-yl]acetyl]amino]benzamide
CID 22197271
2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-N-(9-ethylcarbazol-3-yl)acetamide
CID 22458822
10-[2-oxo-2-[4-(oxolane-2-carbonyl)piperazin-1-yl]ethyl]acridin-9-one
CID 55515627
N-(9-ethylcarbazol-3-yl)-2-sulfanylacetamide
CID 54424608
N-(4-chloro-2-fluorophenyl)-2-[4-[(2R)-oxolane-2-carbonyl]piperazin-1-yl]acetamide
CID 40952888
[2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl]-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium
CID 2404201

Frequently Asked Questions

What is the IUPAC name of N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide?
The IUPAC name of N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide (CID 27248278) is N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide.
What is the SMILES notation for N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide?
The canonical SMILES for N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide is CCn1c2ccccc2c2cc(NC(=O)CN3CCN(C(=O)[C@@H]4CCCO4)CC3)ccc21.
What is the InChIKey of N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide?
The InChIKey is KRPSCKHIMHTEON-QHCPKHFHSA-N. The full InChI is InChI=1S/C25H30N4O3/c1-2-29-21-7-4-3-6-19(21)20-16-18(9-10-22(20)29)26-24(30)17-27-11-13-28(14-12-27)25(31)23-8-5-15-32-23/h3-4,6-7,9-10,16,23H,2,5,8,11-15,17H2,1H3,(H,26,30)/t23-/m0/s1.
What are the key properties of N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide?
N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide has a molecular weight of 434.54 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-ethylcarbazol-3-yl)-2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]acetamide is sourced from PubChem (CID 27248278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).